3-[[2-aminocarbonyl-4-(trifluoromethyl)phenyl]amino]butanoic acid

Systemtic Name: 3-[[2-aminocarbonyl-4-(trifluoromethyl)phenyl]amino]butanoic acid Openeye Name: 3-[2-carbamoyl-4-(trifluoromethyl)anilino]butanoic acid CAS Name: 3-[2-carbamoyl-4-(trifluoromethyl)anilino]butanoic acid IUPAC Name: 3-[2-carbamoyl-4-(trifluoromethyl)anilino]butanoic acid Traditional Name: 3-[2-carbamoyl-4-(trifluoromethyl)anilino]butyric acid Formula: C12H13F3N2O3 MolecularWeight: 290.23843

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC1=C(C=C(C=C1)C(F)(F)F)C(=O)N

Isomeric SMILES

CC(CC(=O)O)NC1=C(C=C(C=C1)C(F)(F)F)C(=O)N

InChI

InChI=1S/C12H13F3N2O3/c1-6(4-10(18)19)17-9-3-2-7(12(13,14)15)5-8(9)11(16)20/h2-3,5-6,17H,4H2,1H3,(H2,16,20)(H,18,19)