4-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]oxybenzoic acid

Systemtic Name: 4-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]oxybenzoic acid Openeye Name: 4-[[4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolyl]oxy]benzoic acid CAS Name: 4-[[4-[2-(2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolinyl]oxy]benzoic acid IUPAC Name: 4-[4-(2-pyridin-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl)quinolin-7-yl]oxybenzoic acid Traditional Name: 4-[[4-[2-(2-pyridyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-7-quinolyl]oxy]benzoic acid Formula: C27H20N4O3 MolecularWeight: 448.4727

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NN2C1)C3=CC=CC=N3)C4=C5C=CC(=CC5=NC=C4)OC6=CC=C(C=C6)C(=O)O

Isomeric SMILES

C1CC2=C(C(=NN2C1)C3=CC=CC=N3)C4=C5C=CC(=CC5=NC=C4)OC6=CC=C(C=C6)C(=O)O

InChI

InChI=1S/C27H20N4O3/c32-27(33)17-6-8-18(9-7-17)34-19-10-11-20-21(12-14-29-23(20)16-19)25-24-5-3-15-31(24)30-26(25)22-4-1-2-13-28-22/h1-2,4,6-14,16H,3,5,15H2,(H,32,33)