5-[2,5-bis(oxidanyl)phenyl]carbonyl-3H-1,3-benzothiazol-2-one

Systemtic Name: 5-[2,5-bis(oxidanyl)phenyl]carbonyl-3H-1,3-benzothiazol-2-one Openeye Name: 5-(2,5-dihydroxybenzoyl)-3H-1,3-benzothiazol-2-one CAS Name: 5-[(2,5-dihydroxyphenyl)-oxomethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 5-(2,5-dihydroxybenzoyl)-3H-1,3-benzothiazol-2-one Traditional Name: 5-gentisoyl-3H-1,3-benzothiazol-2-one Formula: C14H9NO4S MolecularWeight: 287.29056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)C3=C(C=CC(=C3)O)O)NC(=O)S2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)C3=C(C=CC(=C3)O)O)NC(=O)S2

InChI

InChI=1S/C14H9NO4S/c16-8-2-3-11(17)9(6-8)13(18)7-1-4-12-10(5-7)15-14(19)20-12/h1-6,16-17H,(H,15,19)