2,2-bis[2,18-dimethyl-10-(8-methylnonoxy)nonadecan-10-yl]-11-methyl-3-(8-methylnonyl)dodecane-1,3-diol

Systemtic Name: 2,2-bis[2,18-dimethyl-10-(8-methylnonoxy)nonadecan-10-yl]-11-methyl-3-(8-methylnonyl)dodecane-1,3-diol Openeye Name: 11-methyl-2,2-bis[9-methyl-1-(8-methylnonoxy)-1-(8-methylnonyl)decyl]-3-(8-methylnonyl)dodecane-1,3-diol CAS Name: 2,2-bis[2,18-dimethyl-10-(8-methylnonoxy)nonadecan-10-yl]-11-methyl-3-(8-methylnonyl)dodecane-1,3-diol IUPAC Name: 2,2-bis[2,18-dimethyl-10-(8-methylnonoxy)nonadecan-10-yl]-11-methyl-3-(8-methylnonyl)dodecane-1,3-diol Traditional Name: 11-methyl-2,2-bis[9-methyl-1-(8-methylnonoxy)-1-(8-methylnonyl)decyl]-3-(8-methylnonyl)dodecane-1,3-diol Formula: C85H172O4 MolecularWeight: 1258.27278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCC(CCCCCCCC(C)C)(C(CO)(C(CCCCCCCC(C)C)(CCCCCCCC(C)C)OCCCCCCCC(C)C)C(CCCCCCCC(C)C)(CCCCCCCC(C)C)OCCCCCCCC(C)C)O

Isomeric SMILES

CC(C)CCCCCCCC(CCCCCCCC(C)C)(C(CO)(C(CCCCCCCC(C)C)(CCCCCCCC(C)C)OCCCCCCCC(C)C)C(CCCCCCCC(C)C)(CCCCCCCC(C)C)OCCCCCCCC(C)C)O

InChI

InChI=1S/C85H172O4/c1-74(2)57-41-25-17-33-49-65-82(87,66-50-34-18-26-42-58-75(3)4)85(73-86,83(67-51-35-19-27-43-59-76(5)6,68-52-36-20-28-44-60-77(7)8)88-71-55-39-23-31-47-63-80(13)14)84(69-53-37-21-29-45-61-78(9)10,70-54-38-22-30-46-62-79(11)12)89-72-56-40-24-32-48-64-81(15)16/h74-81,86-87H,17-73H2,1-16H3