ethyl (Z)-2,2-bis(fluoranyl)-3-methylsulfanylcarbothioyloxy-octadec-13-enoate

Systemtic Name: ethyl (Z)-2,2-bis(fluoranyl)-3-methylsulfanylcarbothioyloxy-octadec-13-enoate Openeye Name: ethyl (Z)-2,2-difluoro-3-methylsulfanylcarbothioyloxy-octadec-13-enoate CAS Name: (Z)-2,2-difluoro-3-[(methylthio)-sulfanylidenemethoxy]-13-octadecenoic acid ethyl ester IUPAC Name: ethyl (Z)-2,2-difluoro-3-methylsulfanylcarbothioyloxyoctadec-13-enoate Traditional Name: (Z)-2,2-difluoro-3-(methylthio)carbothioyloxy-octadec-13-enoic acid ethyl ester Formula: C22H38F2O3S2 MolecularWeight: 452.662126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CCCCCCCCCCC(C(C(=O)OCC)(F)F)OC(=S)SC

Isomeric SMILES

CCCC/C=C\CCCCCCCCCC(C(C(=O)OCC)(F)F)OC(=S)SC

InChI

InChI=1S/C22H38F2O3S2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19(27-21(28)29-3)22(23,24)20(25)26-5-2/h8-9,19H,4-7,10-18H2,1-3H3/b9-8-