(4-cyclohexyl-4-oxidanylidene-butyl)-ethyl-[1-(4-methoxyphenyl)propan-2-yl]azanium chloride

Systemtic Name: (4-cyclohexyl-4-oxidanylidene-butyl)-ethyl-[1-(4-methoxyphenyl)propan-2-yl]azanium chloride Openeye Name: (4-cyclohexyl-4-oxo-butyl)-ethyl-[2-(4-methoxyphenyl)-1-methyl-ethyl]ammonium chloride CAS Name: (4-cyclohexyl-4-oxobutyl)-ethyl-[1-(4-methoxyphenyl)propan-2-yl]ammonium chloride IUPAC Name: (4-cyclohexyl-4-oxobutyl)-ethyl-[1-(4-methoxyphenyl)propan-2-yl]azanium chloride Traditional Name: (4-cyclohexyl-4-keto-butyl)-ethyl-[2-(4-methoxyphenyl)-1-methyl-ethyl]ammonium chloride Formula: C22H36ClNO2 MolecularWeight: 381.97974

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCC(=O)C1CCCCC1)C(C)CC2=CC=C(C=C2)OC.[Cl-]

Isomeric SMILES

CC[NH+](CCCC(=O)C1CCCCC1)C(C)CC2=CC=C(C=C2)OC.[Cl-]

InChI

InChI=1S/C22H35NO2.ClH/c1-4-23(16-8-11-22(24)20-9-6-5-7-10-20)18(2)17-19-12-14-21(25-3)15-13-19;/h12-15,18,20H,4-11,16-17H2,1-3H3;1H