5-[4-[(Z)-N-(1H-benzimidazol-2-ylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-[(Z)-N-(1H-benzimidazol-2-ylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid Openeye Name: 5-[4-[(Z)-N-(1H-benzimidazol-2-ylamino)-C-methyl-carbonimidoyl]phenyl]furan-2-carboxylic acid CAS Name: 5-[4-[(1Z)-1-(1H-benzimidazol-2-ylhydrazinylidene)ethyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-[(Z)-N-(1H-benzimidazol-2-ylamino)-C-methylcarbonimidoyl]phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-[(Z)-N-(1H-benzimidazol-2-ylamino)-C-methyl-carbonimidoyl]phenyl]-2-furoic acid Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=CC=CC=C2N1)C3=CC=C(C=C3)C4=CC=C(O4)C(=O)O

Isomeric SMILES

C/C(=N/NC1=NC2=CC=CC=C2N1)/C3=CC=C(C=C3)C4=CC=C(O4)C(=O)O

InChI

InChI=1S/C20H16N4O3/c1-12(23-24-20-21-15-4-2-3-5-16(15)22-20)13-6-8-14(9-7-13)17-10-11-18(27-17)19(25)26/h2-11H,1H3,(H,25,26)(H2,21,22,24)/b23-12-