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

Systemtic Name: 2-[2-[4-(5-hexylpyridin-2-yl)phenyl]ethanoyl]-5-pentyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(5-hexyl-2-pyridyl)phenyl]acetyl]-5-pentyl-cyclohexanone CAS Name: 2-[2-[4-(5-hexyl-2-pyridinyl)phenyl]-1-oxoethyl]-5-pentyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(5-hexylpyridin-2-yl)phenyl]acetyl]-5-pentylcyclohexan-1-one Traditional Name: 5-amyl-2-[2-[4-(5-hexyl-2-pyridyl)phenyl]acetyl]cyclohexanone Formula: C30H41NO2 MolecularWeight: 447.65204

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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)CCCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H41NO2/c1-3-5-7-9-11-25-15-19-28(31-22-25)26-16-12-24(13-17-26)21-30(33)27-18-14-23(20-29(27)32)10-8-6-4-2/h12-13,15-17,19,22-23,27H,3-11,14,18,20-21H2,1-2H3