[3-cyclohexyl-3-oxidanyl-3-(4-pentoxyphenyl)propyl]-dimethyl-azanium chloride

Systemtic Name: [3-cyclohexyl-3-oxidanyl-3-(4-pentoxyphenyl)propyl]-dimethyl-azanium chloride Openeye Name: [3-cyclohexyl-3-hydroxy-3-(4-pentoxyphenyl)propyl]-dimethyl-ammonium chloride CAS Name: [3-cyclohexyl-3-hydroxy-3-(4-pentoxyphenyl)propyl]-dimethylammonium chloride IUPAC Name: [3-cyclohexyl-3-hydroxy-3-(4-pentoxyphenyl)propyl]-dimethylazanium chloride Traditional Name: [3-(4-amoxyphenyl)-3-cyclohexyl-3-hydroxy-propyl]-dimethyl-ammonium chloride Formula: C22H38ClNO2 MolecularWeight: 383.99562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(CC[NH+](C)C)(C2CCCCC2)O.[Cl-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(CC[NH+](C)C)(C2CCCCC2)O.[Cl-]

InChI

InChI=1S/C22H37NO2.ClH/c1-4-5-9-18-25-21-14-12-20(13-15-21)22(24,16-17-23(2)3)19-10-7-6-8-11-19;/h12-15,19,24H,4-11,16-18H2,1-3H3;1H