5-(2,5-dimethoxyphenyl)-1-(6,6-dimethylcyclohexen-1-yl)pent-4-yn-1-one

Systemtic Name: 5-(2,5-dimethoxyphenyl)-1-(6,6-dimethylcyclohexen-1-yl)pent-4-yn-1-one Openeye Name: 5-(2,5-dimethoxyphenyl)-1-(6,6-dimethylcyclohexen-1-yl)pent-4-yn-1-one CAS Name: 5-(2,5-dimethoxyphenyl)-1-(6,6-dimethyl-1-cyclohexenyl)-4-pentyn-1-one IUPAC Name: 5-(2,5-dimethoxyphenyl)-1-(6,6-dimethylcyclohexen-1-yl)pent-4-yn-1-one Traditional Name: 5-(2,5-dimethoxyphenyl)-1-(6,6-dimethylcyclohexen-1-yl)pent-4-yn-1-one Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC=C1C(=O)CCC#CC2=C(C=CC(=C2)OC)OC)C

Isomeric SMILES

CC1(CCCC=C1C(=O)CCC#CC2=C(C=CC(=C2)OC)OC)C

InChI

InChI=1S/C21H26O3/c1-21(2)14-8-7-10-18(21)19(22)11-6-5-9-16-15-17(23-3)12-13-20(16)24-4/h10,12-13,15H,6-8,11,14H2,1-4H3