5-[(2,5-dimethylphenyl)methyl]-2-methyl-6-[(E)-2-(3-nitrophenyl)ethenyl]-1H-pyrimidin-4-one

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-2-methyl-6-[(E)-2-(3-nitrophenyl)ethenyl]-1H-pyrimidin-4-one Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-2-methyl-6-[(E)-2-(3-nitrophenyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-2-methyl-6-[(E)-2-(3-nitrophenyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-2-methyl-6-[(E)-2-(3-nitrophenyl)ethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(2,5-dimethylbenzyl)-2-methyl-6-[(E)-2-(3-nitrophenyl)vinyl]-1H-pyrimidin-4-one Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(NC(=NC2=O)C)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(NC(=NC2=O)C)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O3/c1-14-7-8-15(2)18(11-14)13-20-21(23-16(3)24-22(20)26)10-9-17-5-4-6-19(12-17)25(27)28/h4-12H,13H2,1-3H3,(H,23,24,26)/b10-9+