[(2S)-3-(2,5-dimethoxyphenyl)sulfanyl-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(2,5-dimethoxyphenyl)sulfanyl-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(2,5-dimethoxyphenyl)sulfanyl-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-[(2,5-dimethoxyphenyl)thio]-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(2,5-dimethoxyphenyl)sulfanyl-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-[(2,5-dimethoxyphenyl)thio]-2-hydroxy-propyl]-methyl-ammonium Formula: C12H20NO3S+ MolecularWeight: 258.3571

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CSC1=C(C=CC(=C1)OC)OC)O

Isomeric SMILES

C[NH2+]C[C@@H](CSC1=C(C=CC(=C1)OC)OC)O

InChI

InChI=1S/C12H19NO3S/c1-13-7-9(14)8-17-12-6-10(15-2)4-5-11(12)16-3/h4-6,9,13-14H,7-8H2,1-3H3/p+1/t9-/m0/s1