[12,12,12-tris(fluoranyl)-10-phenethyloxycarbothioylsulfanyl-dodecyl] ethanoate

Systemtic Name: [12,12,12-tris(fluoranyl)-10-phenethyloxycarbothioylsulfanyl-dodecyl] ethanoate Openeye Name: (12,12,12-trifluoro-10-phenethyloxycarbothioylsulfanyl-dodecyl) acetate CAS Name: acetic acid [12,12,12-trifluoro-10-[[phenethyloxy(sulfanylidene)methyl]thio]dodecyl] ester IUPAC Name: (12,12,12-trifluoro-10-phenethyloxycarbothioylsulfanyldodecyl) acetate Traditional Name: acetic acid [12,12,12-trifluoro-10-(phenethyloxycarbothioylthio)dodecyl] ester Formula: C23H33F3O3S2 MolecularWeight: 478.63153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCCCCCC(CC(F)(F)F)SC(=S)OCCC1=CC=CC=C1

Isomeric SMILES

CC(=O)OCCCCCCCCCC(CC(F)(F)F)SC(=S)OCCC1=CC=CC=C1

InChI

InChI=1S/C23H33F3O3S2/c1-19(27)28-16-11-6-4-2-3-5-10-14-21(18-23(24,25)26)31-22(30)29-17-15-20-12-8-7-9-13-20/h7-9,12-13,21H,2-6,10-11,14-18H2,1H3