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

Systemtic Name: 3-[3-(1-methylpiperidin-3-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Openeye Name: 3-[3-(1-methyl-3-piperidyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid CAS Name: 3-[3-(1-methyl-3-piperidinyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid IUPAC Name: 3-[3-(1-methylpiperidin-3-yl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Traditional Name: 3-[3-(1-methyl-3-piperidyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)C2=C3CCN=C3N(N2)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

CN1CCCC(C1)C2=C3CCN=C3N(N2)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C18H22N4O2/c1-21-9-3-5-13(11-21)16-15-7-8-19-17(15)22(20-16)14-6-2-4-12(10-14)18(23)24/h2,4,6,10,13,20H,3,5,7-9,11H2,1H3,(H,23,24)