[(1S)-3-azaniumyl-1-(3-methoxy-4-oxidanyl-phenyl)propyl]-dimethyl-azanium

Systemtic Name: [(1S)-3-azaniumyl-1-(3-methoxy-4-oxidanyl-phenyl)propyl]-dimethyl-azanium Openeye Name: [(1S)-3-azaniumyl-1-(4-hydroxy-3-methoxy-phenyl)propyl]-dimethyl-ammonium CAS Name: [(1S)-3-ammonio-1-(4-hydroxy-3-methoxyphenyl)propyl]-dimethylammonium IUPAC Name: [(1S)-3-azaniumyl-1-(4-hydroxy-3-methoxyphenyl)propyl]-dimethylazanium Traditional Name: [(1S)-3-ammonio-1-(4-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=CC(=C(C=C1)O)OC

Isomeric SMILES

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

InChI

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