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

Systemtic Name: dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]-nonyl-azanium chloride Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl-dimethyl-nonyl-ammonium chloride CAS Name: dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]-nonylammonium chloride IUPAC Name: dimethyl-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]-nonylazanium chloride Traditional Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl-dimethyl-nonyl-ammonium chloride Formula: C22H46ClNO MolecularWeight: 376.05974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H46NO.ClH/c1-7-8-9-10-11-12-13-16-23(5,6)18-24-22-17-20(4)14-15-21(22)19(2)3;/h19-22H,7-18H2,1-6H3;1H/q+1;/p-1/t20-,21+,22-;/m1./s1