[(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(1,3-benzodioxol-5-ylthio)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(1,3-benzodioxol-5-ylthio)-2-hydroxy-propyl]-methyl-ammonium Formula: C11H16NO3S+ MolecularWeight: 242.31464

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CSC1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

C[NH2+]C[C@@H](CSC1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C11H15NO3S/c1-12-5-8(13)6-16-9-2-3-10-11(4-9)15-7-14-10/h2-4,8,12-13H,5-7H2,1H3/p+1/t8-/m0/s1