3-[2-methyl-3,4-bis(oxidanyl)pyridin-1-ium-1-yl]propyl pyridine-2-carboxylate

Systemtic Name: 3-[2-methyl-3,4-bis(oxidanyl)pyridin-1-ium-1-yl]propyl pyridine-2-carboxylate Openeye Name: 3-(3,4-dihydroxy-2-methyl-pyridin-1-ium-1-yl)propyl pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid 3-(3,4-dihydroxy-2-methyl-1-pyridin-1-iumyl)propyl ester IUPAC Name: 3-(3,4-dihydroxy-2-methylpyridin-1-ium-1-yl)propyl pyridine-2-carboxylate Traditional Name: picolinic acid 3-(3,4-dihydroxy-2-methyl-pyridin-1-ium-1-yl)propyl ester Formula: C15H17N2O4+ MolecularWeight: 289.30648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC(=C1O)O)CCCOC(=O)C2=CC=CC=N2

Isomeric SMILES

CC1=[N+](C=CC(=C1O)O)CCCOC(=O)C2=CC=CC=N2

InChI

InChI=1S/C15H16N2O4/c1-11-14(19)13(18)6-9-17(11)8-4-10-21-15(20)12-5-2-3-7-16-12/h2-3,5-7,9,19H,4,8,10H2,1H3/p+1