2-methyl-3,4-dioctadecyl-5-prop-1-en-2-yl-cyclohex-2-en-1-one

Systemtic Name: 2-methyl-3,4-dioctadecyl-5-prop-1-en-2-yl-cyclohex-2-en-1-one Openeye Name: 5-isopropenyl-2-methyl-3,4-dioctadecyl-cyclohex-2-en-1-one CAS Name: 2-methyl-5-(1-methylethenyl)-3,4-dioctadecyl-1-cyclohex-2-enone IUPAC Name: 2-methyl-3,4-dioctadecyl-5-prop-1-en-2-ylcyclohex-2-en-1-one Traditional Name: 5-isopropenyl-2-methyl-3,4-distearyl-cyclohex-2-en-1-one Formula: C46H86O MolecularWeight: 655.17444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1C(CC(=O)C(=C1CCCCCCCCCCCCCCCCCC)C)C(=C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1C(CC(=O)C(=C1CCCCCCCCCCCCCCCCCC)C)C(=C)C

InChI

InChI=1S/C46H86O/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-43-42(5)46(47)40-45(41(3)4)44(43)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h44-45H,3,6-40H2,1-2,4-5H3