4-(2-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid

Systemtic Name: 4-(2-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)-2-methyl-5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid Openeye Name: 4-(2-chloro-1-oxido-pyridin-1-ium-3-yl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid CAS Name: 4-(2-chloro-1-oxido-3-pyridin-1-iumyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid IUPAC Name: 4-(2-chloro-1-oxidopyridin-1-ium-3-yl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid Traditional Name: 4-(2-chloro-1-oxido-pyridin-1-ium-3-yl)-5-keto-2-methyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid Formula: C14H11ClN2O5 MolecularWeight: 322.70054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)COC2=O)C3=C([N+](=CC=C3)[O-])Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C2=C(N1)COC2=O)C3=C([N+](=CC=C3)[O-])Cl)C(=O)O

InChI

InChI=1S/C14H11ClN2O5/c1-6-9(13(18)19)10(7-3-2-4-17(21)12(7)15)11-8(16-6)5-22-14(11)20/h2-4,10,16H,5H2,1H3,(H,18,19)