[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecakis(fluoranyl)nonanoate

Systemtic Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecakis(fluoranyl)nonanoate Openeye Name: [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononanoate CAS Name: 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononanoic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluorononanoate Traditional Name: 4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoropelargonic acid [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C36H51F13O2 MolecularWeight: 762.768182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)OC(=O)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C)C

InChI

InChI=1S/C36H51F13O2/c1-20(2)7-6-8-21(3)25-11-12-26-24-10-9-22-19-23(13-16-29(22,4)27(24)14-17-30(25,26)5)51-28(50)15-18-31(37,38)32(39,40)33(41,42)34(43,44)35(45,46)36(47,48)49/h20-27H,6-19H2,1-5H3