(Q4779987)

English

aplindore fumarate

chemical compound

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Statements

type of chemical entity

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chemical compound

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426.1427010439999 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₂N₂O₇

1 reference

canonical SMILES

C1C(OC2=C(O1)C=CC3=C2CC(=O)N3)CNCC4=CC=CC=C4.C(=CC(=O)O)C(=O)O

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isomeric SMILES

c1ccc(cc1)CNC[C@H]2COc3ccc4c(c3O2)CC(=O)N4.C(=C/C(=O)O)C(=O)O

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Identifiers

InChI=1S/C18H18N2O3.C4H4O4/c21-17-8-14-15(20-17)6-7-16-18(14)23-13(11-22-16)10-19-9-12-4-2-1-3-5-12;5-3(6)1-2-4(7)8/h1-7,13,19H,8-11H2,(H,20,21);1-2H,(H,5,6)(H,7,8)/b;2-1+/t13-;/m0./s1

1 reference

GELJVTSEGKGLDF-QDSMGTAFSA-N

1 reference

CAS Registry Number

2 references

imported from Wikimedia project

English Wikipedia

CAS Common Chemistry

6 April 2021

https://commonchemistry.cas.org/detail?cas_rn=189681-71-8

GELJVTSEGKGLDF-QDSMGTAFSA-N

0 references

2 references

imported from Wikimedia project

English Wikipedia

matched by identifier from

GELJVTSEGKGLDF-QDSMGTAFSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

GELJVTSEGKGLDF-QDSMGTAFSA-N

UniChem compound ID

1 reference

0 references

1 reference

matched by identifier from

GELJVTSEGKGLDF-QDSMGTAFSA-N

1 reference

imported from Wikimedia project

English Wikipedia

Sitelinks

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