(2,6-dimethoxy-5-nitro-pyrimidin-4-yl)methyl-triphenyl-phosphanium

Systemtic Name: (2,6-dimethoxy-5-nitro-pyrimidin-4-yl)methyl-triphenyl-phosphanium Openeye Name: (2,6-dimethoxy-5-nitro-pyrimidin-4-yl)methyl-triphenyl-phosphonium CAS Name: (2,6-dimethoxy-5-nitro-4-pyrimidinyl)methyl-triphenylphosphonium IUPAC Name: (2,6-dimethoxy-5-nitropyrimidin-4-yl)methyl-triphenylphosphanium Traditional Name: (2,6-dimethoxy-5-nitro-pyrimidin-4-yl)methyl-triphenyl-phosphonium Formula: C25H23N3O4P+ MolecularWeight: 460.441581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1[N+](=O)[O-])C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=NC(=NC(=C1[N+](=O)[O-])C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H23N3O4P/c1-31-24-23(28(29)30)22(26-25(27-24)32-2)18-33(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,18H2,1-2H3/q+1