2-oxidanyl-2-phosphono-4-(pyridin-3-ylamino)butanoic acid

Systemtic Name: 2-oxidanyl-2-phosphono-4-(pyridin-3-ylamino)butanoic acid Openeye Name: 2-hydroxy-2-phosphono-4-(3-pyridylamino)butanoic acid CAS Name: 2-hydroxy-2-phosphono-4-(3-pyridinylamino)butanoic acid IUPAC Name: 2-hydroxy-2-phosphono-4-(pyridin-3-ylamino)butanoic acid Traditional Name: 2-hydroxy-2-phosphono-4-(3-pyridylamino)butyric acid Formula: C9H13N2O6P MolecularWeight: 276.183081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NCCC(C(=O)O)(O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CN=C1)NCCC(C(=O)O)(O)P(=O)(O)O

InChI

InChI=1S/C9H13N2O6P/c12-8(13)9(14,18(15,16)17)3-5-11-7-2-1-4-10-6-7/h1-2,4,6,11,14H,3,5H2,(H,12,13)(H2,15,16,17)