(Q27166746)

CHEMBL3186312 (English)

10 October 2016

chemical formula

C₂₁H₁₇NO₃

1 reference

CHEMBL3186312 (English)

10 October 2016

canonical SMILES

CC(=CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC3=CC=CC=C3C=C2

1 reference

CHEMBL3186312 (English)

InChI=1S/C21H17NO3/c1-14(16-11-10-15-6-2-3-7-17(15)13-16)12-20(23)22-19-9-5-4-8-18(19)21(24)25/h2-13H,1H3,(H,22,23)(H,24,25)

10 October 2016

Identifiers

InChI

1 reference

CHEMBL3186312 (English)

PGFQXGLPJUCTOI-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

CHEMBL3186312 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-{[3-(2-Naphthyl)-2-butenoyl]amino}benzoic acid (English)

10 October 2016

2 references

CHEMBL3186312 (English)

matched by identifier from

10 October 2016

InChIKey

PGFQXGLPJUCTOI-UHFFFAOYSA-N

ChEBI ID

94985

mapping relation type

2 references

2-[[3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid (English)

matched by identifier from

10 October 2016

International Chemical Identifier

InChI

InChI=1S/C21H17NO3/c1-14(16-11-10-15-6-2-3-7-17(15)13-16)12-20(23)22-19-9-5-4-8-18(19)21(24)25/h2-13H,1H3,(H,22,23)(H,24,25)

1 reference