[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]benzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)carbonylamino]benzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-[(4-chlorobenzoyl)amino]benzoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]benzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-[(4-chlorobenzoyl)amino]benzoate Traditional Name: 2-[(4-chlorobenzoyl)amino]benzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C19H16ClN3O4 MolecularWeight: 385.80104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCC(=O)NCCC#N)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCC(=O)NCCC#N)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H16ClN3O4/c20-14-8-6-13(7-9-14)18(25)23-16-5-2-1-4-15(16)19(26)27-12-17(24)22-11-3-10-21/h1-2,4-9H,3,11-12H2,(H,22,24)(H,23,25)