[1-[2-cyclopentyl-2-(4-methylphenyl)-2-oxidanyl-ethanoyl]piperidin-4-yl]-dimethyl-phenethyl-azanium

Systemtic Name: [1-[2-cyclopentyl-2-(4-methylphenyl)-2-oxidanyl-ethanoyl]piperidin-4-yl]-dimethyl-phenethyl-azanium Openeye Name: [1-[2-cyclopentyl-2-hydroxy-2-(p-tolyl)acetyl]-4-piperidyl]-dimethyl-phenethyl-ammonium CAS Name: [1-[2-cyclopentyl-2-hydroxy-2-(4-methylphenyl)-1-oxoethyl]-4-piperidinyl]-dimethyl-phenethylammonium IUPAC Name: [1-[2-cyclopentyl-2-hydroxy-2-(4-methylphenyl)acetyl]piperidin-4-yl]-dimethyl-phenethylazanium Traditional Name: [1-[2-cyclopentyl-2-hydroxy-2-(p-tolyl)acetyl]-4-piperidyl]-dimethyl-phenethyl-ammonium Formula: C29H41N2O2+ MolecularWeight: 449.64804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CCCC2)(C(=O)N3CCC(CC3)[N+](C)(C)CCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2CCCC2)(C(=O)N3CCC(CC3)[N+](C)(C)CCC4=CC=CC=C4)O

InChI

InChI=1S/C29H41N2O2/c1-23-13-15-26(16-14-23)29(33,25-11-7-8-12-25)28(32)30-20-17-27(18-21-30)31(2,3)22-19-24-9-5-4-6-10-24/h4-6,9-10,13-16,25,27,33H,7-8,11-12,17-22H2,1-3H3/q+1