1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione

Systemtic Name: 1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione Openeye Name: 1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione CAS Name: 1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione IUPAC Name: 1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione Traditional Name: 1-[4-(4-methylcyclohexyl)phenyl]heptane-1,3-dione Formula: C20H28O2 MolecularWeight: 300.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CC(=O)C1=CC=C(C=C1)C2CCC(CC2)C

Isomeric SMILES

CCCCC(=O)CC(=O)C1=CC=C(C=C1)C2CCC(CC2)C

InChI

InChI=1S/C20H28O2/c1-3-4-5-19(21)14-20(22)18-12-10-17(11-13-18)16-8-6-15(2)7-9-16/h10-13,15-16H,3-9,14H2,1-2H3