4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine

Systemtic Name: 4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine Openeye Name: 4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine CAS Name: 4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine IUPAC Name: 4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine Traditional Name: 4-dimethoxyphosphoryl-5-nitro-2-phenyl-1,4-dihydropyrimidine Formula: C12H14N3O5P MolecularWeight: 311.230421

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1C(=CNC(=N1)C2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COP(=O)(C1C(=CNC(=N1)C2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H14N3O5P/c1-19-21(18,20-2)12-10(15(16)17)8-13-11(14-12)9-6-4-3-5-7-9/h3-8,12H,1-2H3,(H,13,14)