ethyl 3-tert-butyl-1,1-bis(oxidanylidene)-1,2-benzothiazole-4-carboxylate

Systemtic Name: ethyl 3-tert-butyl-1,1-bis(oxidanylidene)-1,2-benzothiazole-4-carboxylate Openeye Name: ethyl 3-tert-butyl-1,1-dioxo-1,2-benzothiazole-4-carboxylate CAS Name: 3-tert-butyl-1,1-dioxo-1,2-benzothiazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-tert-butyl-1,1-dioxo-1,2-benzothiazole-4-carboxylate Traditional Name: 3-tert-butyl-1,1-diketo-1,2-benzothiazole-4-carboxylic acid ethyl ester Formula: C14H17NO4S MolecularWeight: 295.35408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)S(=O)(=O)N=C2C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)S(=O)(=O)N=C2C(C)(C)C

InChI

InChI=1S/C14H17NO4S/c1-5-19-13(16)9-7-6-8-10-11(9)12(14(2,3)4)15-20(10,17)18/h6-8H,5H2,1-4H3