(2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) 3-nitrobenzoate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) 3-nitrobenzoate Openeye Name: [2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-piperidin-1-ylethyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-keto-1-phenyl-2-piperidino-ethyl) ester Formula: C20H20N2O5 MolecularWeight: 368.3832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O5/c23-19(21-12-5-2-6-13-21)18(15-8-3-1-4-9-15)27-20(24)16-10-7-11-17(14-16)22(25)26/h1,3-4,7-11,14,18H,2,5-6,12-13H2