[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2E)-7-iodanylocta-2,7-dienoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2E)-7-iodanylocta-2,7-dienoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] (2E)-7-iodoocta-2,7-dienoate CAS Name: (2E)-7-iodoocta-2,7-dienoic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] (2E)-7-iodoocta-2,7-dienoate Traditional Name: (2E)-7-iodoocta-2,7-dienoic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C24H33IO2 MolecularWeight: 480.42209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C=CCCCC(=C)I)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)/C=C/CCCC(=C)I)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C24H33IO2/c1-18-15-16-21(24(3,4)20-12-8-6-9-13-20)22(17-18)27-23(26)14-10-5-7-11-19(2)25/h6,8-10,12-14,18,21-22H,2,5,7,11,15-17H2,1,3-4H3/b14-10+/t18-,21-,22-/m1/s1