(2-oxidanylidene-2-thiophen-2-yl-ethyl) 1-(2-nitrophenyl)piperidine-4-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 1-(2-nitrophenyl)piperidine-4-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 1-(2-nitrophenyl)piperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 1-(2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)isonipecotic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)C2=CC=CS2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)C2=CC=CS2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5S/c21-16(17-6-3-11-26-17)12-25-18(22)13-7-9-19(10-8-13)14-4-1-2-5-15(14)20(23)24/h1-6,11,13H,7-10,12H2