[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl] 4-cyanobenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O4/c19-10-13-6-8-15(9-7-13)17(23)25-12-16(22)21-18(24)20-11-14-4-2-1-3-5-14/h1-9H,11-12H2,(H2,20,21,22,24)