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ethyl 2-[(E)-heptadec-10-en-8-yl]oxy-2-phenylsulfanyl-ethanoate

ethyl 2-[(E)-heptadec-10-en-8-yl]oxy-2-phenylsulfanyl-ethanoate

Systemtic Name:ethyl 2-[(E)-heptadec-10-en-8-yl]oxy-2-phenylsulfanyl-ethanoate
Openeye Name:ethyl 2-[(E)-1-heptyldec-3-enoxy]-2-phenylsulfanyl-acetate
CAS Name:2-[(E)-heptadec-10-en-8-yl]oxy-2-(phenylthio)acetic acid ethyl ester
IUPAC Name:ethyl 2-[(E)-heptadec-10-en-8-yl]oxy-2-phenylsulfanylacetate
Traditional Name:2-[(E)-1-heptyldec-3-enoxy]-2-(phenylthio)acetic acid ethyl ester
Formula: C27H44O3S
MolecularWeight: 448.70146
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC=CCCCCCC)OC(C(=O)OCC)SC1=CC=CC=C1


Isomeric SMILES

CCCCCCCC(C/C=C/CCCCCC)OC(C(=O)OCC)SC1=CC=CC=C1


InChI

InChI=1S/C27H44O3S/c1-4-7-9-11-12-14-17-21-24(20-16-13-10-8-5-2)30-27(26(28)29-6-3)31-25-22-18-15-19-23-25/h14-15,17-19,22-24,27H,4-13,16,20-21H2,1-3H3/b17-14+


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