methyl 4-[4,5-dimethyl-3-oxidanyl-1,1-bis(oxidanylidene)-3H-1,2-thiazol-2-yl]benzoate

Systemtic Name: methyl 4-[4,5-dimethyl-3-oxidanyl-1,1-bis(oxidanylidene)-3H-1,2-thiazol-2-yl]benzoate Openeye Name: methyl 4-(3-hydroxy-4,5-dimethyl-1,1-dioxo-3H-isothiazol-2-yl)benzoate CAS Name: 4-(3-hydroxy-4,5-dimethyl-1,1-dioxo-3H-isothiazol-2-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(3-hydroxy-4,5-dimethyl-1,1-dioxo-3H-1,2-thiazol-2-yl)benzoate Traditional Name: 4-(3-hydroxy-1,1-diketo-4,5-dimethyl-3H-isothiazol-2-yl)benzoic acid methyl ester Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(S(=O)(=O)N(C1O)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=C(S(=O)(=O)N(C1O)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C13H15NO5S/c1-8-9(2)20(17,18)14(12(8)15)11-6-4-10(5-7-11)13(16)19-3/h4-7,12,15H,1-3H3