[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-methylbenzoate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-methylbenzoate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O3/c1-12-6-8-13(9-7-12)17(21)22-11-16(20)19-15-5-3-2-4-14(15)10-18/h2-9H,11H2,1H3,(H,19,20)