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methyl 3-[(1E,3Z)-pentadeca-1,3,6-trienyl]sulfanylpropanoate

methyl 3-[(1E,3Z)-pentadeca-1,3,6-trienyl]sulfanylpropanoate

Systemtic Name:methyl 3-[(1E,3Z)-pentadeca-1,3,6-trienyl]sulfanylpropanoate
Openeye Name:methyl 3-[(1E,3Z)-pentadeca-1,3,6-trienyl]sulfanylpropanoate
CAS Name:3-[[(1E,3Z)-pentadeca-1,3,6-trienyl]thio]propanoic acid methyl ester
IUPAC Name:methyl 3-[(1E,3Z)-pentadeca-1,3,6-trienyl]sulfanylpropanoate
Traditional Name:3-[[(1E,3Z)-pentadeca-1,3,6-trienyl]thio]propionic acid methyl ester
Formula: C19H32O2S
MolecularWeight: 324.52118
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCC=CC=CSCCC(=O)OC


Isomeric SMILES

CCCCCCCCC=CC/C=C\C=C\SCCC(=O)OC


InChI

InChI=1S/C19H32O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-22-18-16-19(20)21-2/h10-11,13-15,17H,3-9,12,16,18H2,1-2H3/b11-10?,14-13-,17-15+


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