methyl 4-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]carbamoyl]benzoate CAS Name: 4-[[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamoyl]benzoate Traditional Name: 4-[[3-(1,3-dihydrobenzimidazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]carbamoyl]benzoic acid methyl ester Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=C3NC4=CC=CC=C4N3)C(=O)C=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=C3NC4=CC=CC=C4N3)C(=O)C=C2

InChI

InChI=1S/C22H17N3O4/c1-29-22(28)14-8-6-13(7-9-14)21(27)23-15-10-11-19(26)16(12-15)20-24-17-4-2-3-5-18(17)25-20/h2-12,24-25H,1H3,(H,23,27)