methyl (2E)-5,9-dimethyl-8-sulfanyl-deca-2,9-dienoate

Systemtic Name: methyl (2E)-5,9-dimethyl-8-sulfanyl-deca-2,9-dienoate Openeye Name: methyl (2E)-5,9-dimethyl-8-sulfanyl-deca-2,9-dienoate CAS Name: (2E)-8-mercapto-5,9-dimethyldeca-2,9-dienoic acid methyl ester IUPAC Name: methyl (2E)-5,9-dimethyl-8-sulfanyldeca-2,9-dienoate Traditional Name: (2E)-8-mercapto-5,9-dimethyl-deca-2,9-dienoic acid methyl ester Formula: C13H22O2S MolecularWeight: 242.37758

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(=C)C)S)CC=CC(=O)OC

Isomeric SMILES

CC(CCC(C(=C)C)S)C/C=C/C(=O)OC

InChI

InChI=1S/C13H22O2S/c1-10(2)12(16)9-8-11(3)6-5-7-13(14)15-4/h5,7,11-12,16H,1,6,8-9H2,2-4H3/b7-5+