ethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]oxy]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]oxy]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)oxy]-3-oxo-butanoate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)oxy]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)oxy]-3-oxobutanoate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)oxy]-3-keto-butyric acid ethyl ester Formula: C13H13NO6S MolecularWeight: 311.31042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)OC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCOC(=O)C(C(=O)C)OC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C13H13NO6S/c1-3-19-13(16)11(8(2)15)20-12-9-6-4-5-7-10(9)21(17,18)14-12/h4-7,11H,3H2,1-2H3