[2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid

Systemtic Name: [2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid Openeye Name: [2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid CAS Name: [2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid IUPAC Name: [2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid Traditional Name: [2,4,6-tricyano-3,5-bis(diethoxyphosphoryl)phenyl]phosphonic acid Formula: C17H22N3O9P3 MolecularWeight: 505.292563

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(C(=C(C(=C1C#N)P(=O)(O)O)C#N)P(=O)(OCC)OCC)C#N)OCC

Isomeric SMILES

CCOP(=O)(C1=C(C(=C(C(=C1C#N)P(=O)(O)O)C#N)P(=O)(OCC)OCC)C#N)OCC

InChI

InChI=1S/C17H22N3O9P3/c1-5-26-31(24,27-6-2)16-12(9-18)15(30(21,22)23)13(10-19)17(14(16)11-20)32(25,28-7-3)29-8-4/h5-8H2,1-4H3,(H2,21,22,23)