[(1S)-2-azaniumyl-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3,4-dimethoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3,4-dimethoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-ammonio-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-ammonium Formula: C12H22N2O2+2 MolecularWeight: 226.31528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O2/c1-14(2)10(8-13)9-5-6-11(15-3)12(7-9)16-4/h5-7,10H,8,13H2,1-4H3/p+2/t10-/m1/s1