2-[[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-[1-(3-pyridinyl)ethyl]phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy(1-pyridin-3-ylethyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]methyl]glutaric acid Formula: C13H18NO6P MolecularWeight: 315.258881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18NO6P/c1-9(10-3-2-6-14-7-10)21(19,20)8-11(13(17)18)4-5-12(15)16/h2-3,6-7,9,11H,4-5,8H2,1H3,(H,15,16)(H,17,18)(H,19,20)