2,4-bis[14-(6-chloranyl-6-oxidanylidene-hexanoyl)oxytetradecyl]-3-methyl-pentanedioic acid

Systemtic Name: 2,4-bis[14-(6-chloranyl-6-oxidanylidene-hexanoyl)oxytetradecyl]-3-methyl-pentanedioic acid Openeye Name: 2,4-bis[14-(6-chloro-6-oxo-hexanoyl)oxytetradecyl]-3-methyl-pentanedioic acid CAS Name: 2,4-bis[14-(6-chloro-1,6-dioxohexoxy)tetradecyl]-3-methylpentanedioic acid IUPAC Name: 2,4-bis[14-(6-chloro-6-oxohexanoyl)oxytetradecyl]-3-methylpentanedioic acid Traditional Name: 2,4-bis[14-(6-chloro-6-keto-hexanoyl)oxytetradecyl]-3-methyl-glutaric acid Formula: C46H80Cl2O10 MolecularWeight: 864.0274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCCCCCCCCCCCCOC(=O)CCCCC(=O)Cl)C(=O)O)C(CCCCCCCCCCCCCCOC(=O)CCCCC(=O)Cl)C(=O)O

Isomeric SMILES

CC(C(CCCCCCCCCCCCCCOC(=O)CCCCC(=O)Cl)C(=O)O)C(CCCCCCCCCCCCCCOC(=O)CCCCC(=O)Cl)C(=O)O

InChI

InChI=1S/C46H80Cl2O10/c1-38(39(45(53)54)30-22-18-14-10-6-2-4-8-12-16-20-28-36-57-43(51)34-26-24-32-41(47)49)40(46(55)56)31-23-19-15-11-7-3-5-9-13-17-21-29-37-58-44(52)35-27-25-33-42(48)50/h38-40H,2-37H2,1H3,(H,53,54)(H,55,56)