4-(3-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl)quinoline-2-carboxylic acid

Systemtic Name: 4-(3-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl)quinoline-2-carboxylic acid Openeye Name: 4-[3-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl]quinoline-2-carboxylic acid CAS Name: 4-[3-(2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl]-2-quinolinecarboxylic acid IUPAC Name: 4-(3-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl)quinoline-2-carboxylic acid Traditional Name: 4-[3-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl]quinaldic acid Formula: C21H16N4O2 MolecularWeight: 356.37734

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NN2C1)C3=CC(=NC4=CC=CC=C43)C(=O)O)C5=CC=CC=N5

Isomeric SMILES

C1CC2=C(C(=NN2C1)C3=CC(=NC4=CC=CC=C43)C(=O)O)C5=CC=CC=N5

InChI

InChI=1S/C21H16N4O2/c26-21(27)17-12-14(13-6-1-2-7-15(13)23-17)20-19(16-8-3-4-10-22-16)18-9-5-11-25(18)24-20/h1-4,6-8,10,12H,5,9,11H2,(H,26,27)