4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]benzoate

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]benzoate Openeye Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]benzoate CAS Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)thio]benzoate IUPAC Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]benzoate Traditional Name: 4-[(1,1-diketo-1,2-benzothiazol-3-yl)thio]benzoate Formula: C14H8NO4S2- MolecularWeight: 318.34762

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)SC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)SC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C14H9NO4S2/c16-14(17)9-5-7-10(8-6-9)20-13-11-3-1-2-4-12(11)21(18,19)15-13/h1-8H,(H,16,17)/p-1