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2,1-benzoxazol-3-ylmethanesulfonic acid

2,1-benzoxazol-3-ylmethanesulfonic acid

Systemtic Name:2,1-benzoxazol-3-ylmethanesulfonic acid
Openeye Name:2,1-benzoxazol-3-ylmethanesulfonic acid
CAS Name:2,1-benzoxazol-3-ylmethanesulfonic acid
IUPAC Name:2,1-benzoxazol-3-ylmethanesulfonic acid
Traditional Name:anthranil-3-ylmethanesulfonic acid
Formula: C8H7NO4S
MolecularWeight: 213.21048
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(ON=C2C=C1)CS(=O)(=O)O


Isomeric SMILES

C1=CC2=C(ON=C2C=C1)CS(=O)(=O)O


InChI

InChI=1S/C8H7NO4S/c10-14(11,12)5-8-6-3-1-2-4-7(6)9-13-8/h1-4H,5H2,(H,10,11,12)


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