6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-hydroxyphenyl)vinyl]-5-isopentyl-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(2-hydroxyphenyl)ethenyl]-2-methyl-5-(3-methylbutyl)-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-hydroxyphenyl)vinyl]-5-isoamyl-2-methyl-1H-pyrimidin-4-one Formula: C18H22N2O2 MolecularWeight: 298.37948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=CC=C2O)CCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=CC=C2O)CCC(C)C

InChI

InChI=1S/C18H22N2O2/c1-12(2)8-10-15-16(19-13(3)20-18(15)22)11-9-14-6-4-5-7-17(14)21/h4-7,9,11-12,21H,8,10H2,1-3H3,(H,19,20,22)/b11-9+