methyl 5-tert-butylsulfanyl-2-methyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-tert-butylsulfanyl-2-methyl-4-oxidanylidene-pentanoate Openeye Name: methyl 5-tert-butylsulfanyl-2-methyl-4-oxo-pentanoate CAS Name: 5-(tert-butylthio)-2-methyl-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-tert-butylsulfanyl-2-methyl-4-oxopentanoate Traditional Name: 5-(tert-butylthio)-4-keto-2-methyl-valeric acid methyl ester Formula: C11H20O3S MolecularWeight: 232.3397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)CSC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(CC(=O)CSC(C)(C)C)C(=O)OC

InChI

InChI=1S/C11H20O3S/c1-8(10(13)14-5)6-9(12)7-15-11(2,3)4/h8H,6-7H2,1-5H3