2-[2-(2-methylpropyl)-4,5-diphenyl-1H-pyrazol-5-yl]propanoic acid

Systemtic Name: 2-[2-(2-methylpropyl)-4,5-diphenyl-1H-pyrazol-5-yl]propanoic acid Openeye Name: 2-(2-isobutyl-4,5-diphenyl-1H-pyrazol-5-yl)propanoic acid CAS Name: 2-[2-(2-methylpropyl)-4,5-diphenyl-1H-pyrazol-5-yl]propanoic acid IUPAC Name: 2-[2-(2-methylpropyl)-4,5-diphenyl-1H-pyrazol-5-yl]propanoic acid Traditional Name: 2-(1-isobutyl-3,4-diphenyl-3-pyrazolin-3-yl)propionic acid Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(N1)(C2=CC=CC=C2)C(C)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C=C(C(N1)(C2=CC=CC=C2)C(C)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O2/c1-16(2)14-24-15-20(18-10-6-4-7-11-18)22(23-24,17(3)21(25)26)19-12-8-5-9-13-19/h4-13,15-17,23H,14H2,1-3H3,(H,25,26)