[(1S,2S)-1-azaniumyl-1-(4-methoxyphenyl)propan-2-yl]-dimethyl-azanium

Systemtic Name: [(1S,2S)-1-azaniumyl-1-(4-methoxyphenyl)propan-2-yl]-dimethyl-azanium Openeye Name: [(1S,2S)-2-azaniumyl-2-(4-methoxyphenyl)-1-methyl-ethyl]-dimethyl-ammonium CAS Name: [(1S,2S)-1-ammonio-1-(4-methoxyphenyl)propan-2-yl]-dimethylammonium IUPAC Name: [(1S,2S)-1-azaniumyl-1-(4-methoxyphenyl)propan-2-yl]-dimethylazanium Traditional Name: [(1S,2S)-2-ammonio-2-(4-methoxyphenyl)-1-methyl-ethyl]-dimethyl-ammonium Formula: C12H22N2O+2 MolecularWeight: 210.31588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)OC)[NH3+])[NH+](C)C

Isomeric SMILES

C[C@@H]([C@H](C1=CC=C(C=C1)OC)[NH3+])[NH+](C)C

InChI

InChI=1S/C12H20N2O/c1-9(14(2)3)12(13)10-5-7-11(15-4)8-6-10/h5-9,12H,13H2,1-4H3/p+2/t9-,12+/m0/s1