2-[6-(3-methoxyphenyl)-3-oxidanylidene-hexyl]-2-propan-2-yl-cyclopentane-1,3-dione

Systemtic Name: 2-[6-(3-methoxyphenyl)-3-oxidanylidene-hexyl]-2-propan-2-yl-cyclopentane-1,3-dione Openeye Name: 2-isopropyl-2-[6-(3-methoxyphenyl)-3-oxo-hexyl]cyclopentane-1,3-dione CAS Name: 2-[6-(3-methoxyphenyl)-3-oxohexyl]-2-propan-2-ylcyclopentane-1,3-dione IUPAC Name: 2-[6-(3-methoxyphenyl)-3-oxohexyl]-2-propan-2-ylcyclopentane-1,3-dione Traditional Name: 2-isopropyl-2-[3-keto-6-(3-methoxyphenyl)hexyl]cyclopentane-1,3-quinone Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)CCC1=O)CCC(=O)CCCC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)C1(C(=O)CCC1=O)CCC(=O)CCCC2=CC(=CC=C2)OC

InChI

InChI=1S/C21H28O4/c1-15(2)21(19(23)10-11-20(21)24)13-12-17(22)8-4-6-16-7-5-9-18(14-16)25-3/h5,7,9,14-15H,4,6,8,10-13H2,1-3H3