(Q53947435)

English

quizalofop-P-tefuryl

chemical compound

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instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

428.11389945199994 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₁ClN₂O₅

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)OCC1CCCO1

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C[C@@H](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)OCC1CCCO1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3/t14-,18?/m1/s1

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InChIKey

BBKDWPHJZANJGB-IKJXHCRLSA-N

1 reference

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1 reference

matched by identifier from

InChIKey

BBKDWPHJZANJGB-IKJXHCRLSA-N

ChEBI ID

81944

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3/t14-,18?/m1/s1

SureChEMBL ID

SCHEMBL1249742

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

BBKDWPHJZANJGB-IKJXHCRLSA-N

1 reference

1 reference

matched by identifier from

InChIKey

BBKDWPHJZANJGB-IKJXHCRLSA-N

EC number

682-785-5

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ECHA Substance Infocard ID

100.207.910

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.207.910

retrieved

27 December 2018

title

oxolan-2-ylmethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate (English)

quotation

CAS no.: 200509-41-7 (English)

UNII

CV677O0SU1

1 reference

matched by identifier from

InChIKey

BBKDWPHJZANJGB-IKJXHCRLSA-N

HCIS ID

5742

0 references

(Q53947435)

quizalofop-P-tefuryl

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Identifiers

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