(3-methylphenyl)-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]methanone

Systemtic Name: (3-methylphenyl)-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]methanone Openeye Name: m-tolyl-[1-[(4-nitrophenyl)methyl]-4-piperidyl]methanone CAS Name: (3-methylphenyl)-[1-[(4-nitrophenyl)methyl]-4-piperidinyl]methanone IUPAC Name: (3-methylphenyl)-[1-[(4-nitrophenyl)methyl]piperidin-4-yl]methanone Traditional Name: m-tolyl-[1-(4-nitrobenzyl)-4-piperidyl]methanone Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O3/c1-15-3-2-4-18(13-15)20(23)17-9-11-21(12-10-17)14-16-5-7-19(8-6-16)22(24)25/h2-8,13,17H,9-12,14H2,1H3