4-[(4-methylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one

Systemtic Name: 4-[(4-methylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one Openeye Name: 5-nitro-4-(p-tolylmethoxy)-1H-pyrimidin-6-one CAS Name: 4-[(4-methylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one IUPAC Name: 4-[(4-methylphenyl)methoxy]-5-nitro-1H-pyrimidin-6-one Traditional Name: 4-(4-methylbenzyl)oxy-5-nitro-1H-pyrimidin-6-one Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C(=O)NC=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4/c1-8-2-4-9(5-3-8)6-19-12-10(15(17)18)11(16)13-7-14-12/h2-5,7H,6H2,1H3,(H,13,14,16)