(3,3-dimethyl-2-oxidanylidene-butyl) 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-(3-chlorophenyl)thiazole-4-carboxylate CAS Name: 2-(3-chlorophenyl)-4-thiazolecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-(3-chlorophenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-chlorophenyl)thiazole-4-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CSC(=N1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CSC(=N1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H16ClNO3S/c1-16(2,3)13(19)8-21-15(20)12-9-22-14(18-12)10-5-4-6-11(17)7-10/h4-7,9H,8H2,1-3H3