5-(2-methylprop-2-enyl)-4-oxidanyl-2-(4-phenylmethoxyphenyl)-1H-pyrimidin-6-one

Systemtic Name: 5-(2-methylprop-2-enyl)-4-oxidanyl-2-(4-phenylmethoxyphenyl)-1H-pyrimidin-6-one Openeye Name: 2-(4-benzyloxyphenyl)-4-hydroxy-5-(2-methylallyl)-1H-pyrimidin-6-one CAS Name: 4-hydroxy-5-(2-methylprop-2-enyl)-2-(4-phenylmethoxyphenyl)-1H-pyrimidin-6-one IUPAC Name: 4-hydroxy-5-(2-methylprop-2-enyl)-2-(4-phenylmethoxyphenyl)-1H-pyrimidin-6-one Traditional Name: 2-(4-benzoxyphenyl)-4-hydroxy-5-(2-methylallyl)-1H-pyrimidin-6-one Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(=C)CC1=C(N=C(NC1=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C21H20N2O3/c1-14(2)12-18-20(24)22-19(23-21(18)25)16-8-10-17(11-9-16)26-13-15-6-4-3-5-7-15/h3-11H,1,12-13H2,2H3,(H2,22,23,24,25)