hexyl-dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]azanium chloride

Systemtic Name: hexyl-dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]azanium chloride Openeye Name: hexyl-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]-dimethyl-ammonium chloride CAS Name: hexyl-dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]ammonium chloride IUPAC Name: hexyl-dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]azanium chloride Traditional Name: hexyl-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]-dimethyl-ammonium chloride Formula: C19H40ClNO MolecularWeight: 333.98

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](C)(C)COC1CC(CCC1C(C)C)C.[Cl-]

Isomeric SMILES

CCCCCC[N+](C)(C)CO[C@@H]1C[C@@H](CC[C@H]1C(C)C)C.[Cl-]

InChI

InChI=1S/C19H40NO.ClH/c1-7-8-9-10-13-20(5,6)15-21-19-14-17(4)11-12-18(19)16(2)3;/h16-19H,7-15H2,1-6H3;1H/q+1;/p-1/t17-,18+,19-;/m1./s1