2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)thio]acetic acid IUPAC Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)thio]acetic acid Formula: C9H7NO4S2 MolecularWeight: 257.28618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)SCC(=O)O

InChI

InChI=1S/C9H7NO4S2/c11-8(12)5-15-9-6-3-1-2-4-7(6)16(13,14)10-9/h1-4H,5H2,(H,11,12)