1-[4-(2-methylpropyl)phenyl]octane-1,3-dione

Systemtic Name: 1-[4-(2-methylpropyl)phenyl]octane-1,3-dione Openeye Name: 1-(4-isobutylphenyl)octane-1,3-dione CAS Name: 1-[4-(2-methylpropyl)phenyl]octane-1,3-dione IUPAC Name: 1-[4-(2-methylpropyl)phenyl]octane-1,3-dione Traditional Name: 1-(4-isobutylphenyl)octane-1,3-dione Formula: C18H26O2 MolecularWeight: 274.39784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(=O)C1=CC=C(C=C1)CC(C)C

Isomeric SMILES

CCCCCC(=O)CC(=O)C1=CC=C(C=C1)CC(C)C

InChI

InChI=1S/C18H26O2/c1-4-5-6-7-17(19)13-18(20)16-10-8-15(9-11-16)12-14(2)3/h8-11,14H,4-7,12-13H2,1-3H3