methyl 2-(2-methyl-4-oxidanylidene-pentan-3-yl)sulfanylethanoate

Systemtic Name: methyl 2-(2-methyl-4-oxidanylidene-pentan-3-yl)sulfanylethanoate Openeye Name: methyl 2-(1-acetyl-2-methyl-propyl)sulfanylacetate CAS Name: 2-[(2-methyl-4-oxopentan-3-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-methyl-4-oxopentan-3-yl)sulfanylacetate Traditional Name: 2-[(1-acetyl-2-methyl-propyl)thio]acetic acid methyl ester Formula: C9H16O3S MolecularWeight: 204.28654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C)SCC(=O)OC

Isomeric SMILES

CC(C)C(C(=O)C)SCC(=O)OC

InChI

InChI=1S/C9H16O3S/c1-6(2)9(7(3)10)13-5-8(11)12-4/h6,9H,5H2,1-4H3