(2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-(2-cyanoethanoylamino)benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-(2-cyanoethanoylamino)benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4-[(2-cyanoacetyl)amino]benzoate CAS Name: 4-[(2-cyano-1-oxoethyl)amino]benzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4-[(2-cyanoacetyl)amino]benzoate Traditional Name: 4-[(2-cyanoacetyl)amino]benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C17H19N3O4/c18-9-8-15(21)19-14-6-4-13(5-7-14)17(23)24-12-16(22)20-10-2-1-3-11-20/h4-7H,1-3,8,10-12H2,(H,19,21)