1-[2-(4-heptylpyrimidin-2-yl)phenyl]-6-methyl-octan-1-one

Systemtic Name: 1-[2-(4-heptylpyrimidin-2-yl)phenyl]-6-methyl-octan-1-one Openeye Name: 1-[2-(4-heptylpyrimidin-2-yl)phenyl]-6-methyl-octan-1-one CAS Name: 1-[2-(4-heptyl-2-pyrimidinyl)phenyl]-6-methyl-1-octanone IUPAC Name: 1-[2-(4-heptylpyrimidin-2-yl)phenyl]-6-methyloctan-1-one Traditional Name: 1-[2-(4-heptylpyrimidin-2-yl)phenyl]-6-methyl-octan-1-one Formula: C26H38N2O MolecularWeight: 394.59272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

Isomeric SMILES

CCCCCCCC1=NC(=NC=C1)C2=CC=CC=C2C(=O)CCCCC(C)CC

InChI

InChI=1S/C26H38N2O/c1-4-6-7-8-9-15-22-19-20-27-26(28-22)24-17-12-11-16-23(24)25(29)18-13-10-14-21(3)5-2/h11-12,16-17,19-21H,4-10,13-15,18H2,1-3H3