[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 4-methyl-2-oxidanyl-benzoate

Systemtic Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 4-methyl-2-oxidanyl-benzoate Openeye Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl] 2-hydroxy-4-methyl-benzoate CAS Name: 2-hydroxy-4-methylbenzoic acid [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] 2-hydroxy-4-methylbenzoate Traditional Name: 2-hydroxy-4-methyl-benzoic acid [(3E)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl] ester Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OCC(=O)C(=C2NC3=CC=CC=C3N2C)C#N)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OCC(=O)/C(=C/2\NC3=CC=CC=C3N2C)/C#N)O

InChI

InChI=1S/C20H17N3O4/c1-12-7-8-13(17(24)9-12)20(26)27-11-18(25)14(10-21)19-22-15-5-3-4-6-16(15)23(19)2/h3-9,22,24H,11H2,1-2H3/b19-14+