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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)C)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=C(NC(=NC2=O)C)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O3/c1-3-16-4-6-18(7-5-16)14-20-21(23-15(2)24-22(20)26)13-10-17-8-11-19(12-9-17)25(27)28/h4-13H,3,14H2,1-2H3,(H,23,24,26)/b13-10+