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

Systemtic Name: 2-[2-[4-(5-hexylpyridin-2-yl)phenyl]ethanoyl]-5-methyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(5-hexyl-2-pyridyl)phenyl]acetyl]-5-methyl-cyclohexanone CAS Name: 2-[2-[4-(5-hexyl-2-pyridinyl)phenyl]-1-oxoethyl]-5-methyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(5-hexylpyridin-2-yl)phenyl]acetyl]-5-methylcyclohexan-1-one Traditional Name: 2-[2-[4-(5-hexyl-2-pyridyl)phenyl]acetyl]-5-methyl-cyclohexanone Formula: C26H33NO2 MolecularWeight: 391.54572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33NO2/c1-3-4-5-6-7-21-11-15-24(27-18-21)22-12-9-20(10-13-22)17-26(29)23-14-8-19(2)16-25(23)28/h9-13,15,18-19,23H,3-8,14,16-17H2,1-2H3