3,5-bis(chloranyl)-4,6-dioctadecyl-cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 3,5-bis(chloranyl)-4,6-dioctadecyl-cyclohexa-3,5-diene-1,2-dione Openeye Name: 3,5-dichloro-4,6-dioctadecyl-1,2-benzoquinone CAS Name: 3,5-dichloro-4,6-dioctadecylcyclohexa-3,5-diene-1,2-dione IUPAC Name: 3,5-dichloro-4,6-dioctadecylcyclohexa-3,5-diene-1,2-dione Traditional Name: 3,5-dichloro-4,6-distearyl-o-benzoquinone Formula: C42H74Cl2O2 MolecularWeight: 681.94176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C(=O)C(=O)C(=C1Cl)CCCCCCCCCCCCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C(=O)C(=O)C(=C1Cl)CCCCCCCCCCCCCCCCCC)Cl

InChI

InChI=1S/C42H74Cl2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(43)38(41(45)42(46)40(37)44)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3