dimethyl-[4-[[(1-oxidanyl-1-phenyl-propan-2-yl)azaniumyl]methyl]phenyl]azanium dichloride

Systemtic Name: dimethyl-[4-[[(1-oxidanyl-1-phenyl-propan-2-yl)azaniumyl]methyl]phenyl]azanium dichloride Openeye Name: [4-[[(2-hydroxy-1-methyl-2-phenyl-ethyl)ammonio]methyl]phenyl]-dimethyl-ammonium dichloride CAS Name: [4-[[(1-hydroxy-1-phenylpropan-2-yl)ammonio]methyl]phenyl]-dimethylammonium dichloride IUPAC Name: [4-[[(1-hydroxy-1-phenylpropan-2-yl)azaniumyl]methyl]phenyl]-dimethylazanium dichloride Traditional Name: [4-[[(2-hydroxy-1-methyl-2-phenyl-ethyl)ammonio]methyl]phenyl]-dimethyl-ammonium dichloride Formula: C18H26Cl2N2O MolecularWeight: 357.31784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH2+]CC2=CC=C(C=C2)[NH+](C)C.[Cl-].[Cl-]

Isomeric SMILES

CC(C(C1=CC=CC=C1)O)[NH2+]CC2=CC=C(C=C2)[NH+](C)C.[Cl-].[Cl-]

InChI

InChI=1S/C18H24N2O.2ClH/c1-14(18(21)16-7-5-4-6-8-16)19-13-15-9-11-17(12-10-15)20(2)3;;/h4-12,14,18-19,21H,13H2,1-3H3;2*1H