5-ethyl-2-[2-[4-(5-pentylpyrimidin-2-yl)phenyl]ethanoyl]cyclohexan-1-one

Systemtic Name: 5-ethyl-2-[2-[4-(5-pentylpyrimidin-2-yl)phenyl]ethanoyl]cyclohexan-1-one Openeye Name: 5-ethyl-2-[2-[4-(5-pentylpyrimidin-2-yl)phenyl]acetyl]cyclohexanone CAS Name: 5-ethyl-2-[1-oxo-2-[4-(5-pentyl-2-pyrimidinyl)phenyl]ethyl]-1-cyclohexanone IUPAC Name: 5-ethyl-2-[2-[4-(5-pentylpyrimidin-2-yl)phenyl]acetyl]cyclohexan-1-one Traditional Name: 2-[2-[4-(5-amylpyrimidin-2-yl)phenyl]acetyl]-5-ethyl-cyclohexanone Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)CC(=O)C3CCC(CC3=O)CC

InChI

InChI=1S/C25H32N2O2/c1-3-5-6-7-20-16-26-25(27-17-20)21-11-8-19(9-12-21)15-24(29)22-13-10-18(4-2)14-23(22)28/h8-9,11-12,16-18,22H,3-7,10,13-15H2,1-2H3