1-(3-methyl-4-nitro-phenyl)carbonyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-methyl-4-nitro-phenyl)carbonyl-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(3-methyl-4-nitro-benzoyl)-N-[2-(2-pyridyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(3-methyl-4-nitrophenyl)-oxomethyl]-N-[2-(2-pyridinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-methyl-4-nitrobenzoyl)-N-(2-pyridin-2-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(3-methyl-4-nitro-benzoyl)-N-[2-(2-pyridyl)ethyl]isonipecotamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)NCCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4/c1-15-14-17(5-6-19(15)25(28)29)21(27)24-12-8-16(9-13-24)20(26)23-11-7-18-4-2-3-10-22-18/h2-6,10,14,16H,7-9,11-13H2,1H3,(H,23,26)