azane; [1-(4-cyanophenyl)-3-[methanoyl(oxidanyl)amino]propyl]phosphonic acid

Systemtic Name: azane; [1-(4-cyanophenyl)-3-[methanoyl(oxidanyl)amino]propyl]phosphonic acid Openeye Name: ammonia; [1-(4-cyanophenyl)-3-[formyl(hydroxy)amino]propyl]phosphonic acid CAS Name: ammonia; [1-(4-cyanophenyl)-3-[formyl(hydroxy)amino]propyl]phosphonic acid IUPAC Name: azane; [1-(4-cyanophenyl)-3-[formyl(hydroxy)amino]propyl]phosphonic acid Traditional Name: ammonia; [1-(4-cyanophenyl)-3-[formyl(hydroxy)amino]propyl]phosphonic acid Formula: C11H19N4O5P MolecularWeight: 318.266121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(CCN(C=O)O)P(=O)(O)O.N.N

Isomeric SMILES

C1=CC(=CC=C1C#N)C(CCN(C=O)O)P(=O)(O)O.N.N

InChI

InChI=1S/C11H13N2O5P.2H3N/c12-7-9-1-3-10(4-2-9)11(19(16,17)18)5-6-13(15)8-14;;/h1-4,8,11,15H,5-6H2,(H2,16,17,18);2*1H3