bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] pyridine-2,6-dicarboxylate

Systemtic Name: bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] pyridine-2,6-dicarboxylate Openeye Name: bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] pyridine-2,6-dicarboxylate CAS Name: pyridine-2,6-dicarboxylic acid bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] ester IUPAC Name: bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] pyridine-2,6-dicarboxylate Traditional Name: pyridine-2,6-dicarboxylic acid bis[dimethoxyphosphoryl-(3-nitrophenyl)methyl] ester Formula: C25H25N3O14P2 MolecularWeight: 653.425222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O14P2/c1-37-43(35,38-2)24(16-8-5-10-18(14-16)27(31)32)41-22(29)20-12-7-13-21(26-20)23(30)42-25(44(36,39-3)40-4)17-9-6-11-19(15-17)28(33)34/h5-15,24-25H,1-4H3