[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(3-acetamidoanilino)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(3-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetamidoanilino)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(3-acetamidoanilino)-2-keto-ethyl] ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H15N3O4/c1-12(22)20-15-3-2-4-16(9-15)21-17(23)11-25-18(24)14-7-5-13(10-19)6-8-14/h2-9H,11H2,1H3,(H,20,22)(H,21,23)