methyl 1-[2-nitro-4-(phenylcarbonyl)phenyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-nitro-4-(phenylcarbonyl)phenyl]piperidine-4-carboxylate Openeye Name: methyl 1-(4-benzoyl-2-nitro-phenyl)piperidine-4-carboxylate CAS Name: 1-(4-benzoyl-2-nitrophenyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-benzoyl-2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(4-benzoyl-2-nitro-phenyl)isonipecotic acid methyl ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O5/c1-27-20(24)15-9-11-21(12-10-15)17-8-7-16(13-18(17)22(25)26)19(23)14-5-3-2-4-6-14/h2-8,13,15H,9-12H2,1H3