3-[5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoic acid

Systemtic Name: 3-[5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoic acid Openeye Name: 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid CAS Name: 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid IUPAC Name: 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid Traditional Name: 3-[2-amino-4-keto-3-(6-methyl-1H-benzimidazol-2-yl)-2-pyrrolin-1-yl]benzoic acid Formula: C19H16N4O3 MolecularWeight: 348.35534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C3=C(N(CC3=O)C4=CC=CC(=C4)C(=O)O)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C3=C(N(CC3=O)C4=CC=CC(=C4)C(=O)O)N

InChI

InChI=1S/C19H16N4O3/c1-10-5-6-13-14(7-10)22-18(21-13)16-15(24)9-23(17(16)20)12-4-2-3-11(8-12)19(25)26/h2-8H,9,20H2,1H3,(H,21,22)(H,25,26)