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

Systemtic Name: 3-(1,3-benzodioxol-5-ylcarbonyl)-6-methyl-pyridine-2-carboxylic acid Openeye Name: 3-(1,3-benzodioxole-5-carbonyl)-6-methyl-pyridine-2-carboxylic acid CAS Name: 3-[1,3-benzodioxol-5-yl(oxo)methyl]-6-methyl-2-pyridinecarboxylic acid IUPAC Name: 3-(1,3-benzodioxole-5-carbonyl)-6-methylpyridine-2-carboxylic acid Traditional Name: 6-methyl-3-piperonyloyl-picolinic acid Formula: C15H11NO5 MolecularWeight: 285.25154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C15H11NO5/c1-8-2-4-10(13(16-8)15(18)19)14(17)9-3-5-11-12(6-9)21-7-20-11/h2-6H,7H2,1H3,(H,18,19)