[2,2-dimethyl-3-[[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azaniumyl]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azaniumyl]propyl]-dimethyl-azanium Openeye Name: [3-[[(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]ammonio]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]azaniumyl]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C16H30N2O+2 MolecularWeight: 266.4222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)[NH2+]CC(C)(C)C[NH+](C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C)O

InChI

InChI=1S/C16H28N2O/c1-12-7-8-14(15(19)9-12)13(2)17-10-16(3,4)11-18(5)6/h7-9,13,17,19H,10-11H2,1-6H3/p+2/t13-/m0/s1