2-(3-oxidanylidene-1-phenyl-butyl)cyclohexane-1,3-dione

Systemtic Name: 2-(3-oxidanylidene-1-phenyl-butyl)cyclohexane-1,3-dione Openeye Name: 2-(3-oxo-1-phenyl-butyl)cyclohexane-1,3-dione CAS Name: 2-(3-oxo-1-phenylbutyl)cyclohexane-1,3-dione IUPAC Name: 2-(3-oxo-1-phenylbutyl)cyclohexane-1,3-dione Traditional Name: 2-(3-keto-1-phenyl-butyl)cyclohexane-1,3-quinone Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1C(=O)CCCC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(C1C(=O)CCCC1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18O3/c1-11(17)10-13(12-6-3-2-4-7-12)16-14(18)8-5-9-15(16)19/h2-4,6-7,13,16H,5,8-10H2,1H3