3-[3-(oxolan-2-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid

Systemtic Name: 3-[3-(oxolan-2-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Openeye Name: 3-(3-tetrahydrofuran-2-yl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid CAS Name: 3-[3-(2-oxolanyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid IUPAC Name: 3-[3-(oxolan-2-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Traditional Name: 3-[3-(tetrahydrofuryl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=C3CCN=C3N(N2)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CC(OC1)C2=C3CCN=C3N(N2)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C16H17N3O3/c20-16(21)10-3-1-4-11(9-10)19-15-12(6-7-17-15)14(18-19)13-5-2-8-22-13/h1,3-4,9,13,18H,2,5-8H2,(H,20,21)