3-(4-phenylphenyl)-2-[[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-phenylphenyl)-2-[[1-phenyl-5-(trifluoromethyl)pyrazol-4-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-phenylphenyl)-2-[[1-phenyl-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]propanoic acid CAS Name: 2-[[oxo-[1-phenyl-5-(trifluoromethyl)-4-pyrazolyl]methyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 3-(4-phenylphenyl)-2-[[1-phenyl-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]propanoic acid Traditional Name: 3-(4-phenylphenyl)-2-[[1-phenyl-5-(trifluoromethyl)pyrazole-4-carbonyl]amino]propionic acid Formula: C26H20F3N3O3 MolecularWeight: 479.45051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C26H20F3N3O3/c27-26(28,29)23-21(16-30-32(23)20-9-5-2-6-10-20)24(33)31-22(25(34)35)15-17-11-13-19(14-12-17)18-7-3-1-4-8-18/h1-14,16,22H,15H2,(H,31,33)(H,34,35)