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

Systemtic Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]ethanoyl]-5-pentyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]-5-pentyl-cyclohexanone CAS Name: 2-[2-[4-(5-decyl-2-pyrimidinyl)phenyl]-1-oxoethyl]-5-pentyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]-5-pentylcyclohexan-1-one Traditional Name: 5-amyl-2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]cyclohexanone Formula: C33H48N2O2 MolecularWeight: 504.74642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CCCCC

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CCCCC

InChI

InChI=1S/C33H48N2O2/c1-3-5-7-8-9-10-11-13-15-28-24-34-33(35-25-28)29-19-16-27(17-20-29)23-32(37)30-21-18-26(22-31(30)36)14-12-6-4-2/h16-17,19-20,24-26,30H,3-15,18,21-23H2,1-2H3