6-cyclopentyl-6-[2-(3-propan-2-ylphenyl)ethynyl]oxane-2,4-dione

Systemtic Name: 6-cyclopentyl-6-[2-(3-propan-2-ylphenyl)ethynyl]oxane-2,4-dione Openeye Name: 6-cyclopentyl-6-[2-(3-isopropylphenyl)ethynyl]tetrahydropyran-2,4-dione CAS Name: 6-cyclopentyl-6-[2-(3-propan-2-ylphenyl)ethynyl]oxane-2,4-dione IUPAC Name: 6-cyclopentyl-6-[2-(3-propan-2-ylphenyl)ethynyl]oxane-2,4-dione Traditional Name: 6-cyclopentyl-6-(2-m-cumenylethynyl)tetrahydropyran-2,4-quinone Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC(=C1)C#CC2(CC(=O)CC(=O)O2)C3CCCC3

Isomeric SMILES

CC(C)C1=CC=CC(=C1)C#CC2(CC(=O)CC(=O)O2)C3CCCC3

InChI

InChI=1S/C21H24O3/c1-15(2)17-7-5-6-16(12-17)10-11-21(18-8-3-4-9-18)14-19(22)13-20(23)24-21/h5-7,12,15,18H,3-4,8-9,13-14H2,1-2H3