4-(1-phosphonoethyl)pyridine-2-carboxylic acid

Systemtic Name: 4-(1-phosphonoethyl)pyridine-2-carboxylic acid Openeye Name: 4-(1-phosphonoethyl)pyridine-2-carboxylic acid CAS Name: 4-(1-phosphonoethyl)-2-pyridinecarboxylic acid IUPAC Name: 4-(1-phosphonoethyl)pyridine-2-carboxylic acid Traditional Name: 4-(1-phosphonoethyl)picolinic acid Formula: C8H10NO5P MolecularWeight: 231.142461

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=NC=C1)C(=O)O)P(=O)(O)O

Isomeric SMILES

CC(C1=CC(=NC=C1)C(=O)O)P(=O)(O)O

InChI

InChI=1S/C8H10NO5P/c1-5(15(12,13)14)6-2-3-9-7(4-6)8(10)11/h2-5H,1H3,(H,10,11)(H2,12,13,14)