[(1S)-3-azaniumyl-1-(3-methoxy-2-oxidanyl-phenyl)propyl]-dimethyl-azanium

Systemtic Name: [(1S)-3-azaniumyl-1-(3-methoxy-2-oxidanyl-phenyl)propyl]-dimethyl-azanium Openeye Name: [(1S)-3-azaniumyl-1-(2-hydroxy-3-methoxy-phenyl)propyl]-dimethyl-ammonium CAS Name: [(1S)-3-ammonio-1-(2-hydroxy-3-methoxyphenyl)propyl]-dimethylammonium IUPAC Name: [(1S)-3-azaniumyl-1-(2-hydroxy-3-methoxyphenyl)propyl]-dimethylazanium Traditional Name: [(1S)-3-ammonio-1-(2-hydroxy-3-methoxy-phenyl)propyl]-dimethyl-ammonium Formula: C12H22N2O2+2 MolecularWeight: 226.31528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O2/c1-14(2)10(7-8-13)9-5-4-6-11(16-3)12(9)15/h4-6,10,15H,7-8,13H2,1-3H3/p+2/t10-/m0/s1