2-[2-[4-(4-hexylphenyl)phenyl]ethanoyl]-5-pentyl-cyclohexan-1-one

Systemtic Name: 2-[2-[4-(4-hexylphenyl)phenyl]ethanoyl]-5-pentyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(4-hexylphenyl)phenyl]acetyl]-5-pentyl-cyclohexanone CAS Name: 2-[2-[4-(4-hexylphenyl)phenyl]-1-oxoethyl]-5-pentyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(4-hexylphenyl)phenyl]acetyl]-5-pentylcyclohexan-1-one Traditional Name: 5-amyl-2-[2-[4-(4-hexylphenyl)phenyl]acetyl]cyclohexanone Formula: C31H42O2 MolecularWeight: 446.66398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CCCCC

InChI

InChI=1S/C31H42O2/c1-3-5-7-9-10-24-12-17-27(18-13-24)28-19-14-26(15-20-28)23-31(33)29-21-16-25(22-30(29)32)11-8-6-4-2/h12-15,17-20,25,29H,3-11,16,21-23H2,1-2H3