[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-methylphenyl)amino]benzoate

Systemtic Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] 2-[(4-methylphenyl)amino]benzoate Openeye Name: [2-[(2-cyanobenzofuran-3-yl)amino]-2-oxo-ethyl] 2-(4-methylanilino)benzoate CAS Name: 2-(4-methylanilino)benzoic acid [2-[(2-cyano-3-benzofuranyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] 2-(4-methylanilino)benzoate Traditional Name: 2-(p-toluidino)benzoic acid [2-[(2-cyanobenzofuran-3-yl)amino]-2-keto-ethyl] ester Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)OCC(=O)NC3=C(OC4=CC=CC=C43)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=CC=CC=C2C(=O)OCC(=O)NC3=C(OC4=CC=CC=C43)C#N

InChI

InChI=1S/C25H19N3O4/c1-16-10-12-17(13-11-16)27-20-8-4-2-6-18(20)25(30)31-15-23(29)28-24-19-7-3-5-9-21(19)32-22(24)14-26/h2-13,27H,15H2,1H3,(H,28,29)