[(1E,3E,5E,9E,13E,15E,17E)-3,7,12,16-tetramethyl-14-(phenylsulfonyl)-1,18-bis(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,9,13,15,17-heptaen-5-yl]sulfonylbenzene

Systemtic Name: [(1E,3E,5E,9E,13E,15E,17E)-3,7,12,16-tetramethyl-14-(phenylsulfonyl)-1,18-bis(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,9,13,15,17-heptaen-5-yl]sulfonylbenzene Openeye Name: [(1E,5E,9E,11E,13E)-10-(benzenesulfonyl)-3,8,12-trimethyl-1-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]-14-(2,6,6-trimethylcyclohexen-1-yl)tetradeca-1,5,9,11,13-pentaenyl]sulfonylbenzene CAS Name: [(1E,3E,5E,9E,13E,15E,17E)-14-(benzenesulfonyl)-3,7,12,16-tetramethyl-1,18-bis(2,6,6-trimethyl-1-cyclohexenyl)octadeca-1,3,5,9,13,15,17-heptaen-5-yl]sulfonylbenzene IUPAC Name: [(1E,3E,5E,9E,13E,15E,17E)-14-(benzenesulfonyl)-3,7,12,16-tetramethyl-1,18-bis(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,9,13,15,17-heptaen-5-yl]sulfonylbenzene Traditional Name: [(1E,5E,9E,11E,13E)-10-besyl-3,8,12-trimethyl-1-[(1E,3E)-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]-14-(2,6,6-trimethylcyclohexen-1-yl)tetradeca-1,5,9,11,13-pentaenyl]sulfonylbenzene Formula: C52H68O4S2 MolecularWeight: 821.22392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=CC(=CC(C)CC=CCC(C)C=C(C=C(C)C=CC2=C(CCCC2(C)C)C)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C(=C\C(C/C=C/CC(/C=C(/S(=O)(=O)C2=CC=CC=C2)\C=C(\C=C\C3=C(CCCC3(C)C)C)/C)C)C)/S(=O)(=O)C4=CC=CC=C4)/C

InChI

InChI=1S/C52H68O4S2/c1-39(35-47(57(53,54)45-25-13-11-14-26-45)37-41(3)29-31-49-43(5)23-19-33-51(49,7)8)21-17-18-22-40(2)36-48(58(55,56)46-27-15-12-16-28-46)38-42(4)30-32-50-44(6)24-20-34-52(50,9)10/h11-18,25-32,35-40H,19-24,33-34H2,1-10H3/b18-17+,31-29+,32-30+,41-37+,42-38+,47-35+,48-36+