6-(5-pyridin-4-ylcarbonyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)pyridine-3-carboxylic acid

Systemtic Name: 6-(5-pyridin-4-ylcarbonyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)pyridine-3-carboxylic acid Openeye Name: 6-[5-(pyridine-4-carbonyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]pyridine-3-carboxylic acid CAS Name: 6-[5-[oxo(pyridin-4-yl)methyl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-3-pyridinecarboxylic acid IUPAC Name: 6-[5-(pyridine-4-carbonyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]pyridine-3-carboxylic acid Traditional Name: 6-(5-isonicotinoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)nicotinic acid Formula: C17H13N5O3 MolecularWeight: 335.31682

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1C(=O)C3=CC=NC=C3)NN=C2C4=NC=C(C=C4)C(=O)O

Isomeric SMILES

C1C2=C(CN1C(=O)C3=CC=NC=C3)NN=C2C4=NC=C(C=C4)C(=O)O

InChI

InChI=1S/C17H13N5O3/c23-16(10-3-5-18-6-4-10)22-8-12-14(9-22)20-21-15(12)13-2-1-11(7-19-13)17(24)25/h1-7H,8-9H2,(H,20,21)(H,24,25)