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

Systemtic Name: 4-[[1-cyclohexyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-cyclohexyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[1-cyclohexyl-2-(trifluoromethyl)-5-benzimidazolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[1-cyclohexyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[1-cyclohexyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-keto-butyric acid Formula: C18H20F3N3O3 MolecularWeight: 383.36491

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)NC(=O)CCC(=O)O)N=C2C(F)(F)F

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)NC(=O)CCC(=O)O)N=C2C(F)(F)F

InChI

InChI=1S/C18H20F3N3O3/c19-18(20,21)17-23-13-10-11(22-15(25)8-9-16(26)27)6-7-14(13)24(17)12-4-2-1-3-5-12/h6-7,10,12H,1-5,8-9H2,(H,22,25)(H,26,27)