O1-butyl O5-(2-prop-2-enoxyethyl) 4-methyl-2-sulfanyl-pentanedioate

Systemtic Name: O1-butyl O5-(2-prop-2-enoxyethyl) 4-methyl-2-sulfanyl-pentanedioate Openeye Name: O1-(2-allyloxyethyl) O5-butyl 2-methyl-4-sulfanyl-pentanedioate CAS Name: 2-mercapto-4-methylpentanedioic acid O1-butyl ester O5-(2-prop-2-enoxyethyl) ester IUPAC Name: 1-O-butyl 5-O-(2-prop-2-enoxyethyl) 4-methyl-2-sulfanylpentanedioate Traditional Name: 4-mercapto-2-methyl-glutaric acid O1-(2-allyloxyethyl) ester O5-butyl ester Formula: C15H26O5S MolecularWeight: 318.42894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC(C)C(=O)OCCOCC=C)S

Isomeric SMILES

CCCCOC(=O)C(CC(C)C(=O)OCCOCC=C)S

InChI

InChI=1S/C15H26O5S/c1-4-6-8-19-15(17)13(21)11-12(3)14(16)20-10-9-18-7-5-2/h5,12-13,21H,2,4,6-11H2,1,3H3