ethyl 1-(2-methyl-3-nitro-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methyl-3-nitro-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-methyl-3-nitro-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methyl-3-nitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methyl-3-nitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(2-methyl-3-nitro-benzoyl)isonipecotic acid ethyl ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O5/c1-3-23-16(20)12-7-9-17(10-8-12)15(19)13-5-4-6-14(11(13)2)18(21)22/h4-6,12H,3,7-10H2,1-2H3