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

Systemtic Name: 1-[4-(4-octylcyclohexyl)phenyl]heptane-1,3-dione Openeye Name: 1-[4-(4-octylcyclohexyl)phenyl]heptane-1,3-dione CAS Name: 1-[4-(4-octylcyclohexyl)phenyl]heptane-1,3-dione IUPAC Name: 1-[4-(4-octylcyclohexyl)phenyl]heptane-1,3-dione Traditional Name: 1-[4-(4-octylcyclohexyl)phenyl]heptane-1,3-dione Formula: C27H42O2 MolecularWeight: 398.62118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(=O)CCCC

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)CC(=O)CCCC

InChI

InChI=1S/C27H42O2/c1-3-5-7-8-9-10-11-22-13-15-23(16-14-22)24-17-19-25(20-18-24)27(29)21-26(28)12-6-4-2/h17-20,22-23H,3-16,21H2,1-2H3