5-[(3-nitrophenyl)methyl]-1H-pyrimidin-6-one

Systemtic Name: 5-[(3-nitrophenyl)methyl]-1H-pyrimidin-6-one Openeye Name: 5-[(3-nitrophenyl)methyl]-1H-pyrimidin-6-one CAS Name: 5-[(3-nitrophenyl)methyl]-1H-pyrimidin-6-one IUPAC Name: 5-[(3-nitrophenyl)methyl]-1H-pyrimidin-6-one Traditional Name: 5-(3-nitrobenzyl)-1H-pyrimidin-6-one Formula: C11H9N3O3 MolecularWeight: 231.20746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CC2=CN=CNC2=O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CC2=CN=CNC2=O

InChI

InChI=1S/C11H9N3O3/c15-11-9(6-12-7-13-11)4-8-2-1-3-10(5-8)14(16)17/h1-3,5-7H,4H2,(H,12,13,15)