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

Systemtic Name: methyl 1-(3-methyl-4-nitro-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3-methyl-4-nitro-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(3-methyl-4-nitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-methyl-4-nitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3-methyl-4-nitro-benzoyl)isonipecotic acid methyl ester Formula: C15H18N2O5 MolecularWeight: 306.31382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O5/c1-10-9-12(3-4-13(10)17(20)21)14(18)16-7-5-11(6-8-16)15(19)22-2/h3-4,9,11H,5-8H2,1-2H3