1-butyl-1-cyclohexyl-5-[2-(2,2-dimethylpropoxy)phenyl]-3-piperidin-1-yl-imidazolidin-1-ium-2-one

Systemtic Name: 1-butyl-1-cyclohexyl-5-[2-(2,2-dimethylpropoxy)phenyl]-3-piperidin-1-yl-imidazolidin-1-ium-2-one Openeye Name: 1-butyl-1-cyclohexyl-5-[2-(2,2-dimethylpropoxy)phenyl]-3-(1-piperidyl)imidazolidin-1-ium-2-one CAS Name: 1-butyl-1-cyclohexyl-5-[2-(2,2-dimethylpropoxy)phenyl]-3-(1-piperidinyl)-2-imidazolidin-1-iumone IUPAC Name: 1-butyl-1-cyclohexyl-5-[2-(2,2-dimethylpropoxy)phenyl]-3-piperidin-1-ylimidazolidin-1-ium-2-one Traditional Name: 1-butyl-1-cyclohexyl-5-(2-neopentyloxyphenyl)-3-piperidino-imidazolidin-1-ium-2-one Formula: C29H48N3O2+ MolecularWeight: 470.71032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C(CN(C1=O)N2CCCCC2)C3=CC=CC=C3OCC(C)(C)C)C4CCCCC4

Isomeric SMILES

CCCC[N+]1(C(CN(C1=O)N2CCCCC2)C3=CC=CC=C3OCC(C)(C)C)C4CCCCC4

InChI

InChI=1S/C29H48N3O2/c1-5-6-21-32(24-15-9-7-10-16-24)26(22-31(28(32)33)30-19-13-8-14-20-30)25-17-11-12-18-27(25)34-23-29(2,3)4/h11-12,17-18,24,26H,5-10,13-16,19-23H2,1-4H3/q+1