3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)-3H-benzimidazol-5-yl]carbonylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)-3H-benzimidazole-5-carbonyl]amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[oxo-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]methyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)-3H-benzimidazole-5-carbonyl]amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(trifluoromethyl)-3H-benzimidazole-5-carbonyl]amino]propionic acid Formula: C20H15F3N4O3 MolecularWeight: 416.35331

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC4=C(C=C3)N=C(N4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC4=C(C=C3)N=C(N4)C(F)(F)F

InChI

InChI=1S/C20H15F3N4O3/c21-20(22,23)19-26-14-6-5-10(7-15(14)27-19)17(28)25-16(18(29)30)8-11-9-24-13-4-2-1-3-12(11)13/h1-7,9,16,24H,8H2,(H,25,28)(H,26,27)(H,29,30)