dimethyl 2-[(1E,3E,10E)-1-ethylsulfanyldodeca-1,3,10-trien-2-yl]propanedioate

Systemtic Name: dimethyl 2-[(1E,3E,10E)-1-ethylsulfanyldodeca-1,3,10-trien-2-yl]propanedioate Openeye Name: dimethyl 2-[(1E,2E,9E)-1-(ethylsulfanylmethylene)undeca-2,9-dienyl]propanedioate CAS Name: 2-[(1E,3E,10E)-1-(ethylthio)dodeca-1,3,10-trien-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1E,3E,10E)-1-ethylsulfanyldodeca-1,3,10-trien-2-yl]propanedioate Traditional Name: 2-[(1E,2E,9E)-1-[(ethylthio)methylene]undeca-2,9-dienyl]malonic acid dimethyl ester Formula: C19H30O4S MolecularWeight: 354.5041

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Descriptors Computed from Structure

Canonical SMILES:

CCSC=C(C=CCCCCCC=CC)C(C(=O)OC)C(=O)OC

Isomeric SMILES

CCS/C=C(\C=C\CCCCC/C=C/C)/C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H30O4S/c1-5-7-8-9-10-11-12-13-14-16(15-24-6-2)17(18(20)22-3)19(21)23-4/h5,7,13-15,17H,6,8-12H2,1-4H3/b7-5+,14-13+,16-15+