1-ethyl-7-(1-oxidanidylpyridin-1-ium-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-(1-oxidanidylpyridin-1-ium-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-(1-oxidopyridin-1-ium-4-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-(1-oxido-4-pyridin-1-iumyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-(1-oxidopyridin-1-ium-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-4-keto-7-(1-oxidopyridin-1-ium-4-yl)quinoline-3-carboxylic acid Formula: C17H14N2O4 MolecularWeight: 310.30406

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=[N+](C=C3)[O-])C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=[N+](C=C3)[O-])C(=O)O

InChI

InChI=1S/C17H14N2O4/c1-2-18-10-14(17(21)22)16(20)13-4-3-12(9-15(13)18)11-5-7-19(23)8-6-11/h3-10H,2H2,1H3,(H,21,22)