5-methyl-2-[2-[4-(4-octylphenyl)phenyl]ethanoyl]cyclohexan-1-one

Systemtic Name: 5-methyl-2-[2-[4-(4-octylphenyl)phenyl]ethanoyl]cyclohexan-1-one Openeye Name: 5-methyl-2-[2-[4-(4-octylphenyl)phenyl]acetyl]cyclohexanone CAS Name: 5-methyl-2-[2-[4-(4-octylphenyl)phenyl]-1-oxoethyl]-1-cyclohexanone IUPAC Name: 5-methyl-2-[2-[4-(4-octylphenyl)phenyl]acetyl]cyclohexan-1-one Traditional Name: 5-methyl-2-[2-[4-(4-octylphenyl)phenyl]acetyl]cyclohexanone Formula: C29H38O2 MolecularWeight: 418.61082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)C

InChI

InChI=1S/C29H38O2/c1-3-4-5-6-7-8-9-23-11-15-25(16-12-23)26-17-13-24(14-18-26)21-29(31)27-19-10-22(2)20-28(27)30/h11-18,22,27H,3-10,19-21H2,1-2H3