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

Systemtic Name: 4-[3-(piperidin-1-ylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Openeye Name: 4-[3-(1-piperidylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid CAS Name: 4-[3-(1-piperidinylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid IUPAC Name: 4-[3-(piperidin-1-ylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Traditional Name: 4-[3-(piperidinomethyl)-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:

C1CCN(CC1)CC2=C3CCN=C3N(N2)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(CC1)CC2=C3CCN=C3N(N2)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H22N4O2/c23-18(24)13-4-6-14(7-5-13)22-17-15(8-9-19-17)16(20-22)12-21-10-2-1-3-11-21/h4-7,20H,1-3,8-12H2,(H,23,24)