2-octyl-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-octyl-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-octyl-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-octyl-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-octyl-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-octyl-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NC(=O)C=C(N1)C2=CC=NC=C2

Isomeric SMILES

CCCCCCCCC1=NC(=O)C=C(N1)C2=CC=NC=C2

InChI

InChI=1S/C17H23N3O/c1-2-3-4-5-6-7-8-16-19-15(13-17(21)20-16)14-9-11-18-12-10-14/h9-13H,2-8H2,1H3,(H,19,20,21)