6-[(E)-2-(2-fluorophenyl)ethenyl]-5-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(2-fluorophenyl)ethenyl]-5-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-fluorophenyl)vinyl]-5-[(4-methoxy-3-nitro-phenyl)methyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-fluorophenyl)ethenyl]-5-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(2-fluorophenyl)ethenyl]-5-[(4-methoxy-3-nitrophenyl)methyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-fluorophenyl)vinyl]-5-(4-methoxy-3-nitro-benzyl)-2-methyl-1H-pyrimidin-4-one Formula: C21H18FN3O4 MolecularWeight: 395.383723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=CC=C2F)CC3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=CC=C2F)CC3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H18FN3O4/c1-13-23-18(9-8-15-5-3-4-6-17(15)22)16(21(26)24-13)11-14-7-10-20(29-2)19(12-14)25(27)28/h3-10,12H,11H2,1-2H3,(H,23,24,26)/b9-8+