6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-octyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-octyl-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-hydroxyphenyl)vinyl]-2-methyl-5-octyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-octyl-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-octyl-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-hydroxyphenyl)vinyl]-2-methyl-5-octyl-1H-pyrimidin-4-one Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NC(=NC1=O)C)C=CC2=CC=CC=C2O

Isomeric SMILES

CCCCCCCCC1=C(NC(=NC1=O)C)/C=C/C2=CC=CC=C2O

InChI

InChI=1S/C21H28N2O2/c1-3-4-5-6-7-8-12-18-19(22-16(2)23-21(18)25)15-14-17-11-9-10-13-20(17)24/h9-11,13-15,24H,3-8,12H2,1-2H3,(H,22,23,25)/b15-14+