2-[oxidanyl(1-pyridin-3-ylpropyl)phosphoryl]oxypentanedioic acid

Systemtic Name: 2-[oxidanyl(1-pyridin-3-ylpropyl)phosphoryl]oxypentanedioic acid Openeye Name: 2-[hydroxy-[1-(3-pyridyl)propyl]phosphoryl]oxypentanedioic acid CAS Name: 2-[hydroxy-[1-(3-pyridinyl)propyl]phosphoryl]oxypentanedioic acid IUPAC Name: 2-[hydroxy(1-pyridin-3-ylpropyl)phosphoryl]oxypentanedioic acid Traditional Name: 2-[hydroxy-[1-(3-pyridyl)propyl]phosphoryl]oxyglutaric acid Formula: C13H18NO7P MolecularWeight: 331.258281

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=CC=C1)P(=O)(O)OC(CCC(=O)O)C(=O)O

Isomeric SMILES

CCC(C1=CN=CC=C1)P(=O)(O)OC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C13H18NO7P/c1-2-11(9-4-3-7-14-8-9)22(19,20)21-10(13(17)18)5-6-12(15)16/h3-4,7-8,10-11H,2,5-6H2,1H3,(H,15,16)(H,17,18)(H,19,20)