[2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] 2-ethylhexyl carbonate

Systemtic Name: [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] 2-ethylhexyl carbonate Openeye Name: [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl] 2-ethylhexyl carbonate CAS Name: carbonic acid [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl] 2-ethylhexyl ester IUPAC Name: [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxocyclohexen-1-yl] 2-ethylhexyl carbonate Traditional Name: carbonic acid [2-(2,4-dimethylphenyl)-3-keto-5,5-dimethyl-cyclohexen-1-yl] 2-ethylhexyl ester Formula: C25H36O4 MolecularWeight: 400.55094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)OC1=C(C(=O)CC(C1)(C)C)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCC(CC)COC(=O)OC1=C(C(=O)CC(C1)(C)C)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C25H36O4/c1-7-9-10-19(8-2)16-28-24(27)29-22-15-25(5,6)14-21(26)23(22)20-12-11-17(3)13-18(20)4/h11-13,19H,7-10,14-16H2,1-6H3