5,5-dimethyl-2-[(9Z,12Z)-octadeca-9,12-dienoyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(9Z,12Z)-octadeca-9,12-dienoyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(9Z,12Z)-octadeca-9,12-dienoyl]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(9Z,12Z)-1-oxooctadeca-9,12-dienyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(9Z,12Z)-octadeca-9,12-dienoyl]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(9Z,12Z)-octadeca-9,12-dienoyl]cyclohexane-1,3-quinone Formula: C26H42O3 MolecularWeight: 402.60988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)C1C(=O)CC(CC1=O)(C)C

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)C1C(=O)CC(CC1=O)(C)C

InChI

InChI=1S/C26H42O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(27)25-23(28)20-26(2,3)21-24(25)29/h8-9,11-12,25H,4-7,10,13-21H2,1-3H3/b9-8-,12-11-