5-butyl-2-[4-(4-pentylphenyl)phenyl]cyclohexan-1-one

Systemtic Name: 5-butyl-2-[4-(4-pentylphenyl)phenyl]cyclohexan-1-one Openeye Name: 5-butyl-2-[4-(4-pentylphenyl)phenyl]cyclohexanone CAS Name: 5-butyl-2-[4-(4-pentylphenyl)phenyl]-1-cyclohexanone IUPAC Name: 5-butyl-2-[4-(4-pentylphenyl)phenyl]cyclohexan-1-one Traditional Name: 2-[4-(4-amylphenyl)phenyl]-5-butyl-cyclohexanone Formula: C27H36O MolecularWeight: 376.57414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3=O)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3=O)CCCC

InChI

InChI=1S/C27H36O/c1-3-5-7-9-21-10-13-23(14-11-21)24-15-17-25(18-16-24)26-19-12-22(8-6-4-2)20-27(26)28/h10-11,13-18,22,26H,3-9,12,19-20H2,1-2H3