[(1R)-1-(3-nitrophenyl)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: [(1R)-1-(3-nitrophenyl)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid [(1R)-1-(3-nitrophenyl)ethyl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O5/c1-15(17-6-5-9-19(14-17)24(27)28)29-20(25)16-10-12-23(13-11-16)21(26)22-18-7-3-2-4-8-18/h2-9,14-16H,10-13H2,1H3,(H,22,26)/t15-/m1/s1