4-[[1-methyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[1-methyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-methyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[1-methyl-2-(trifluoromethyl)-5-benzimidazolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[1-methyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[1-methyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]butyric acid Formula: C13H12F3N3O3 MolecularWeight: 315.24789

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)N=C1C(F)(F)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)N=C1C(F)(F)F

InChI

InChI=1S/C13H12F3N3O3/c1-19-9-3-2-7(17-10(20)4-5-11(21)22)6-8(9)18-12(19)13(14,15)16/h2-3,6H,4-5H2,1H3,(H,17,20)(H,21,22)