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

Systemtic Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]ethanoyl]-5-heptyl-cyclohexan-1-one Openeye Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]-5-heptyl-cyclohexanone CAS Name: 2-[2-[4-(5-decyl-2-pyrimidinyl)phenyl]-1-oxoethyl]-5-heptyl-1-cyclohexanone IUPAC Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]-5-heptylcyclohexan-1-one Traditional Name: 2-[2-[4-(5-decylpyrimidin-2-yl)phenyl]acetyl]-5-heptyl-cyclohexanone Formula: C35H52N2O2 MolecularWeight: 532.79958

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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)CCCCCCC

Isomeric SMILES

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

InChI

InChI=1S/C35H52N2O2/c1-3-5-7-9-10-11-13-15-17-30-26-36-35(37-27-30)31-21-18-29(19-22-31)25-34(39)32-23-20-28(24-33(32)38)16-14-12-8-6-4-2/h18-19,21-22,26-28,32H,3-17,20,23-25H2,1-2H3