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

Systemtic Name: 6-chloranylhexyl [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl] carbonate Openeye Name: 6-chlorohexyl [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxo-cyclohexen-1-yl] carbonate CAS Name: carbonic acid 6-chlorohexyl [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxo-1-cyclohexenyl] ester IUPAC Name: 6-chlorohexyl [2-(2,4-dimethylphenyl)-5,5-dimethyl-3-oxocyclohexen-1-yl] carbonate Traditional Name: carbonic acid 6-chlorohexyl [2-(2,4-dimethylphenyl)-3-keto-5,5-dimethyl-cyclohexen-1-yl] ester Formula: C23H31ClO4 MolecularWeight: 406.94284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(CC(CC2=O)(C)C)OC(=O)OCCCCCCCl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(CC(CC2=O)(C)C)OC(=O)OCCCCCCCl)C

InChI

InChI=1S/C23H31ClO4/c1-16-9-10-18(17(2)13-16)21-19(25)14-23(3,4)15-20(21)28-22(26)27-12-8-6-5-7-11-24/h9-10,13H,5-8,11-12,14-15H2,1-4H3