[phosphonomethyl(2-pyridin-2-ylethyl)amino]methylphosphonic acid

Systemtic Name: [phosphonomethyl(2-pyridin-2-ylethyl)amino]methylphosphonic acid Openeye Name: [phosphonomethyl-[2-(2-pyridyl)ethyl]amino]methylphosphonic acid CAS Name: [phosphonomethyl-[2-(2-pyridinyl)ethyl]amino]methylphosphonic acid IUPAC Name: [phosphonomethyl(2-pyridin-2-ylethyl)amino]methylphosphonic acid Traditional Name: [phosphonomethyl-[2-(2-pyridyl)ethyl]amino]methylphosphonic acid Formula: C9H16N2O6P2 MolecularWeight: 310.180662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCN(CP(=O)(O)O)CP(=O)(O)O

Isomeric SMILES

C1=CC=NC(=C1)CCN(CP(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C9H16N2O6P2/c12-18(13,14)7-11(8-19(15,16)17)6-4-9-3-1-2-5-10-9/h1-3,5H,4,6-8H2,(H2,12,13,14)(H2,15,16,17)