(4-nitrophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (4-nitrobenzyl) ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O5/c24-19(28-14-15-6-8-18(9-7-15)23(26)27)16-10-12-22(13-11-16)20(25)21-17-4-2-1-3-5-17/h1-9,16H,10-14H2,(H,21,25)