2-butanoyl-5-(4-methylphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-butanoyl-5-(4-methylphenyl)cyclohexane-1,3-dione Openeye Name: 2-butanoyl-5-(p-tolyl)cyclohexane-1,3-dione CAS Name: 5-(4-methylphenyl)-2-(1-oxobutyl)cyclohexane-1,3-dione IUPAC Name: 2-butanoyl-5-(4-methylphenyl)cyclohexane-1,3-dione Traditional Name: 2-butyryl-5-(p-tolyl)cyclohexane-1,3-quinone Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(CC1=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC(=O)C1C(=O)CC(CC1=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H20O3/c1-3-4-14(18)17-15(19)9-13(10-16(17)20)12-7-5-11(2)6-8-12/h5-8,13,17H,3-4,9-10H2,1-2H3