(2S,4S)-2-[6-(3-methoxyphenyl)-3-oxidanylidene-hexyl]-2,4-dimethyl-cyclopentane-1,3-dione

Systemtic Name: (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxidanylidene-hexyl]-2,4-dimethyl-cyclopentane-1,3-dione Openeye Name: (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxo-hexyl]-2,4-dimethyl-cyclopentane-1,3-dione CAS Name: (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxohexyl]-2,4-dimethylcyclopentane-1,3-dione IUPAC Name: (2S,4S)-2-[6-(3-methoxyphenyl)-3-oxohexyl]-2,4-dimethylcyclopentane-1,3-dione Traditional Name: (2S,4S)-2-[3-keto-6-(3-methoxyphenyl)hexyl]-2,4-dimethyl-cyclopentane-1,3-quinone Formula: C20H26O4 MolecularWeight: 330.41804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C1=O)(C)CCC(=O)CCCC2=CC(=CC=C2)OC

Isomeric SMILES

C[C@H]1CC(=O)[C@](C1=O)(C)CCC(=O)CCCC2=CC(=CC=C2)OC

InChI

InChI=1S/C20H26O4/c1-14-12-18(22)20(2,19(14)23)11-10-16(21)8-4-6-15-7-5-9-17(13-15)24-3/h5,7,9,13-14H,4,6,8,10-12H2,1-3H3/t14-,20-/m0/s1