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

Systemtic Name: 2-[oxidanyl(1-pyridin-3-ylethyl)phosphoryl]oxypentanedioic acid Openeye Name: 2-[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]oxypentanedioic acid CAS Name: 2-[hydroxy-[1-(3-pyridinyl)ethyl]phosphoryl]oxypentanedioic acid IUPAC Name: 2-[hydroxy(1-pyridin-3-ylethyl)phosphoryl]oxypentanedioic acid Traditional Name: 2-[hydroxy-[1-(3-pyridyl)ethyl]phosphoryl]oxyglutaric acid Formula: C12H16NO7P MolecularWeight: 317.231701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16NO7P/c1-8(9-3-2-6-13-7-9)21(18,19)20-10(12(16)17)4-5-11(14)15/h2-3,6-8,10H,4-5H2,1H3,(H,14,15)(H,16,17)(H,18,19)