diundecyl 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylate

Systemtic Name: diundecyl 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylate Openeye Name: diundecyl 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylate CAS Name: 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylic acid diundecyl ester IUPAC Name: diundecyl 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylate Traditional Name: 4-[(3E)-4,8-dimethylnona-3,7-dienyl]cyclohexa-1,4-diene-1,2-dicarboxylic acid diundecyl ester Formula: C41H70O4 MolecularWeight: 626.9921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=C(CC(=CC1)CCC=C(C)CCC=C(C)C)C(=O)OCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=C(CC(=CC1)CC/C=C(\C)/CCC=C(C)C)C(=O)OCCCCCCCCCCC

InChI

InChI=1S/C41H70O4/c1-6-8-10-12-14-16-18-20-22-32-44-40(42)38-31-30-37(29-25-28-36(5)27-24-26-35(3)4)34-39(38)41(43)45-33-23-21-19-17-15-13-11-9-7-2/h26,28,30H,6-25,27,29,31-34H2,1-5H3/b36-28+