[(1R)-1-phenylethyl] 1-(2-nitrophenyl)piperidine-4-carboxylate

Systemtic Name: [(1R)-1-phenylethyl] 1-(2-nitrophenyl)piperidine-4-carboxylate Openeye Name: [(1R)-1-phenylethyl] 1-(2-nitrophenyl)piperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 1-(2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)isonipecotic acid [(1R)-1-phenylethyl] ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4/c1-15(16-7-3-2-4-8-16)26-20(23)17-11-13-21(14-12-17)18-9-5-6-10-19(18)22(24)25/h2-10,15,17H,11-14H2,1H3/t15-/m1/s1