6-chloranyl-2-sulfanylidene-3H-1,3-benzoxazole-4-sulfonic acid

Systemtic Name: 6-chloranyl-2-sulfanylidene-3H-1,3-benzoxazole-4-sulfonic acid Openeye Name: 6-chloro-2-thioxo-3H-1,3-benzoxazole-4-sulfonic acid CAS Name: 6-chloro-2-sulfanylidene-3H-1,3-benzoxazole-4-sulfonic acid IUPAC Name: 6-chloro-2-sulfanylidene-3H-1,3-benzoxazole-4-sulfonic acid Traditional Name: 6-chloro-2-thioxo-3H-1,3-benzoxazole-4-sulfonic acid Formula: C7H4ClNO4S2 MolecularWeight: 265.69396

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1S(=O)(=O)O)NC(=S)O2)Cl

Isomeric SMILES

C1=C(C=C2C(=C1S(=O)(=O)O)NC(=S)O2)Cl

InChI

InChI=1S/C7H4ClNO4S2/c8-3-1-4-6(9-7(14)13-4)5(2-3)15(10,11)12/h1-2H,(H,9,14)(H,10,11,12)