4-[[[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid Openeye Name: 4-[[[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid CAS Name: 4-[[[3-(4-oxo-1-cyclohexa-2,5-dienylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid IUPAC Name: 4-[[[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid Traditional Name: 4-[[[3-(4-ketocyclohexa-2,5-dien-1-ylidene)-7H-imidazo[1,2-a]pyrazin-8-yl]amino]methyl]benzoic acid Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2C=NC3=C(NC=CN23)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC(=O)C=CC1=C2C=NC3=C(NC=CN23)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H16N4O3/c25-16-7-5-14(6-8-16)17-12-23-19-18(21-9-10-24(17)19)22-11-13-1-3-15(4-2-13)20(26)27/h1-10,12,21-22H,11H2,(H,26,27)