1-[4-(3-methylbutyl)phenyl]butane-1,3-dione

Systemtic Name: 1-[4-(3-methylbutyl)phenyl]butane-1,3-dione Openeye Name: 1-(4-isopentylphenyl)butane-1,3-dione CAS Name: 1-[4-(3-methylbutyl)phenyl]butane-1,3-dione IUPAC Name: 1-[4-(3-methylbutyl)phenyl]butane-1,3-dione Traditional Name: 1-(4-isoamylphenyl)butane-1,3-dione Formula: C15H20O2 MolecularWeight: 232.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C(C=C1)C(=O)CC(=O)C

Isomeric SMILES

CC(C)CCC1=CC=C(C=C1)C(=O)CC(=O)C

InChI

InChI=1S/C15H20O2/c1-11(2)4-5-13-6-8-14(9-7-13)15(17)10-12(3)16/h6-9,11H,4-5,10H2,1-3H3