3-(1,3-benzodioxol-5-ylcarbonyl)-6-(hydroxymethyl)pyridine-2-carboxylic acid

Systemtic Name: 3-(1,3-benzodioxol-5-ylcarbonyl)-6-(hydroxymethyl)pyridine-2-carboxylic acid Openeye Name: 3-(1,3-benzodioxole-5-carbonyl)-6-(hydroxymethyl)pyridine-2-carboxylic acid CAS Name: 3-[1,3-benzodioxol-5-yl(oxo)methyl]-6-(hydroxymethyl)-2-pyridinecarboxylic acid IUPAC Name: 3-(1,3-benzodioxole-5-carbonyl)-6-(hydroxymethyl)pyridine-2-carboxylic acid Traditional Name: 6-methylol-3-piperonyloyl-picolinic acid Formula: C15H11NO6 MolecularWeight: 301.25094

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C3=C(N=C(C=C3)CO)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C3=C(N=C(C=C3)CO)C(=O)O

InChI

InChI=1S/C15H11NO6/c17-6-9-2-3-10(13(16-9)15(19)20)14(18)8-1-4-11-12(5-8)22-7-21-11/h1-5,17H,6-7H2,(H,19,20)