(2-methyl-5-nitro-pyridin-3-yl)-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]methanone

Systemtic Name: (2-methyl-5-nitro-pyridin-3-yl)-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]methanone Openeye Name: (2-methyl-5-nitro-3-pyridyl)-[4-[2-(p-tolyl)ethyl]-1-piperidyl]methanone CAS Name: (2-methyl-5-nitro-3-pyridinyl)-[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]methanone IUPAC Name: (2-methyl-5-nitropyridin-3-yl)-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]methanone Traditional Name: (2-methyl-5-nitro-3-pyridyl)-[4-[2-(p-tolyl)ethyl]piperidino]methanone Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=CC(=CN=C3C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=CC(=CN=C3C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-15-3-5-17(6-4-15)7-8-18-9-11-23(12-10-18)21(25)20-13-19(24(26)27)14-22-16(20)2/h3-6,13-14,18H,7-12H2,1-2H3