1,3-benzoxazol-2-ylsulfanylmethanesulfonic acid

Systemtic Name: 1,3-benzoxazol-2-ylsulfanylmethanesulfonic acid Openeye Name: 1,3-benzoxazol-2-ylsulfanylmethanesulfonic acid CAS Name: (1,3-benzoxazol-2-ylthio)methanesulfonic acid IUPAC Name: 1,3-benzoxazol-2-ylsulfanylmethanesulfonic acid Traditional Name: (1,3-benzoxazol-2-ylthio)methanesulfonic acid Formula: C8H7NO4S2 MolecularWeight: 245.27548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCS(=O)(=O)O

InChI

InChI=1S/C8H7NO4S2/c10-15(11,12)5-14-8-9-6-3-1-2-4-7(6)13-8/h1-4H,5H2,(H,10,11,12)