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

Systemtic Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-(1,3-benzodioxol-5-ylthio)-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(1,3-benzodioxol-5-ylsulfanyl)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(1,3-benzodioxol-5-ylthio)-2-hydroxy-propyl]ammonium Formula: C10H14NO3S+ MolecularWeight: 228.28806

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)SCC(C[NH3+])O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)SC[C@H](C[NH3+])O

InChI

InChI=1S/C10H13NO3S/c11-4-7(12)5-15-8-1-2-9-10(3-8)14-6-13-9/h1-3,7,12H,4-6,11H2/p+1/t7-/m0/s1