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

Systemtic Name: [(2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-hydroxy-propyl]ammonium CAS Name: [(2S)-3-(1,3-benzoxazol-2-ylthio)-2-hydroxypropyl]ammonium IUPAC Name: [(2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-hydroxypropyl]azanium Traditional Name: [(2S)-3-(1,3-benzoxazol-2-ylthio)-2-hydroxy-propyl]ammonium Formula: C10H13N2O2S+ MolecularWeight: 225.28742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(C[NH3+])O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC[C@H](C[NH3+])O

InChI

InChI=1S/C10H12N2O2S/c11-5-7(13)6-15-10-12-8-3-1-2-4-9(8)14-10/h1-4,7,13H,5-6,11H2/p+1/t7-/m0/s1