[3-[2-(2-methylphenyl)ethyl]piperidin-1-yl]-(1-oxidanidylpyridin-1-ium-4-yl)methanone

Systemtic Name: [3-[2-(2-methylphenyl)ethyl]piperidin-1-yl]-(1-oxidanidylpyridin-1-ium-4-yl)methanone Openeye Name: [3-[2-(o-tolyl)ethyl]-1-piperidyl]-(1-oxidopyridin-1-ium-4-yl)methanone CAS Name: [3-[2-(2-methylphenyl)ethyl]-1-piperidinyl]-(1-oxido-4-pyridin-1-iumyl)methanone IUPAC Name: [3-[2-(2-methylphenyl)ethyl]piperidin-1-yl]-(1-oxidopyridin-1-ium-4-yl)methanone Traditional Name: [3-[2-(o-tolyl)ethyl]piperidino]-(1-oxidopyridin-1-ium-4-yl)methanone Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC2CCCN(C2)C(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

CC1=CC=CC=C1CCC2CCCN(C2)C(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C20H24N2O2/c1-16-5-2-3-7-18(16)9-8-17-6-4-12-21(15-17)20(23)19-10-13-22(24)14-11-19/h2-3,5,7,10-11,13-14,17H,4,6,8-9,12,15H2,1H3