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

Systemtic Name: 4-oxidanylidene-4-[[1-(phenylmethyl)-2-(trifluoromethyl)benzimidazol-5-yl]amino]butanoic acid Openeye Name: 4-[[1-benzyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[[1-(phenylmethyl)-2-(trifluoromethyl)-5-benzimidazolyl]amino]butanoic acid IUPAC Name: 4-[[1-benzyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[1-benzyl-2-(trifluoromethyl)benzimidazol-5-yl]amino]-4-keto-butyric acid Formula: C19H16F3N3O3 MolecularWeight: 391.34385

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)CCC(=O)O)N=C2C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC(=O)CCC(=O)O)N=C2C(F)(F)F

InChI

InChI=1S/C19H16F3N3O3/c20-19(21,22)18-24-14-10-13(23-16(26)8-9-17(27)28)6-7-15(14)25(18)11-12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H,23,26)(H,27,28)