(3,3-dimethyl-2-oxidanylidene-butyl) 4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-[1,1-bis(oxidanylidene)-1,2-thiazolidin-2-yl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoate CAS Name: 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzoate Traditional Name: 4-(1,1-diketo-1,2-thiazolidin-2-yl)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H21NO5S MolecularWeight: 339.40664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)N2CCCS2(=O)=O

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=C(C=C1)N2CCCS2(=O)=O

InChI

InChI=1S/C16H21NO5S/c1-16(2,3)14(18)11-22-15(19)12-5-7-13(8-6-12)17-9-4-10-23(17,20)21/h5-8H,4,9-11H2,1-3H3