(2-azanyl-2-oxidanylidene-ethyl) 4-[3-(4-cyanophenyl)propanoyl]piperazine-1-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-[3-(4-cyanophenyl)propanoyl]piperazine-1-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 4-[3-(4-cyanophenyl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(4-cyanophenyl)-1-oxopropyl]-1-piperazinecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-[3-(4-cyanophenyl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-cyanophenyl)propanoyl]piperazine-1-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CC=C(C=C2)C#N)C(=O)OCC(=O)N

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CC=C(C=C2)C#N)C(=O)OCC(=O)N

InChI

InChI=1S/C17H20N4O4/c18-11-14-3-1-13(2-4-14)5-6-16(23)20-7-9-21(10-8-20)17(24)25-12-15(19)22/h1-4H,5-10,12H2,(H2,19,22)