3-[(2-oxidanylidene-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid

Systemtic Name: 3-[(2-oxidanylidene-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid Openeye Name: 3-[(2-oxo-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid CAS Name: 3-[(2-oxo-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid IUPAC Name: 3-[(2-oxo-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid Traditional Name: 3-[(2-keto-1,3-benzoxathiol-5-yl)oxysulfonyl]benzoic acid Formula: C14H8O7S2 MolecularWeight: 352.33912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC(=O)S3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)OC(=O)S3)C(=O)O

InChI

InChI=1S/C14H8O7S2/c15-13(16)8-2-1-3-10(6-8)23(18,19)21-9-4-5-11-12(7-9)22-14(17)20-11/h1-7H,(H,15,16)