2-cyclopentyl-2-[2-(4-ethanoyl-3-methyl-phenyl)ethyl]-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 2-cyclopentyl-2-[2-(4-ethanoyl-3-methyl-phenyl)ethyl]-6-oxidanyl-3H-pyran-4-one Openeye Name: 2-[2-(4-acetyl-3-methyl-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one CAS Name: 2-[2-(4-acetyl-3-methylphenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one IUPAC Name: 2-[2-(4-acetyl-3-methylphenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one Traditional Name: 2-[2-(4-acetyl-3-methyl-phenyl)ethyl]-2-cyclopentyl-6-hydroxy-3H-pyran-4-one Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCC2(CC(=O)C=C(O2)O)C3CCCC3)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)CCC2(CC(=O)C=C(O2)O)C3CCCC3)C(=O)C

InChI

InChI=1S/C21H26O4/c1-14-11-16(7-8-19(14)15(2)22)9-10-21(17-5-3-4-6-17)13-18(23)12-20(24)25-21/h7-8,11-12,17,24H,3-6,9-10,13H2,1-2H3