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

Systemtic Name: 3-[3-(diphenylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid Openeye Name: 3-(3-benzhydryl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid CAS Name: 3-[3-(diphenylmethyl)-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl]benzoic acid IUPAC Name: 3-(3-benzhydryl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Traditional Name: 3-(3-benzhydryl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2C1=C(NN2C3=CC=CC(=C3)C(=O)O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN=C2C1=C(NN2C3=CC=CC(=C3)C(=O)O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O2/c29-25(30)19-12-7-13-20(16-19)28-24-21(14-15-26-24)23(27-28)22(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-13,16,22,27H,14-15H2,(H,29,30)