4-ethoxy-7-oxidanidyl-1-pentyl-pyrazolo[3,4-b]pyridin-7-ium-5-carboxylic acid

Systemtic Name: 4-ethoxy-7-oxidanidyl-1-pentyl-pyrazolo[3,4-b]pyridin-7-ium-5-carboxylic acid Openeye Name: 4-ethoxy-7-oxido-1-pentyl-pyrazolo[3,4-b]pyridin-7-ium-5-carboxylic acid CAS Name: 4-ethoxy-7-oxido-1-pentyl-5-pyrazolo[3,4-b]pyridin-7-iumcarboxylic acid IUPAC Name: 4-ethoxy-7-oxido-1-pentylpyrazolo[3,4-b]pyridin-7-ium-5-carboxylic acid Traditional Name: 1-amyl-4-ethoxy-7-oxido-pyrazolo[3,4-b]pyridin-7-ium-5-carboxylic acid Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=[N+](C=C(C(=C2C=N1)OCC)C(=O)O)[O-]

Isomeric SMILES

CCCCCN1C2=[N+](C=C(C(=C2C=N1)OCC)C(=O)O)[O-]

InChI

InChI=1S/C14H19N3O4/c1-3-5-6-7-16-13-10(8-15-16)12(21-4-2)11(14(18)19)9-17(13)20/h8-9H,3-7H2,1-2H3,(H,18,19)