4-(3,4-dimethoxyphenyl)-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoic acid

Systemtic Name: 4-(3,4-dimethoxyphenyl)-2-[2,2,2-tris(fluoranyl)ethanoylamino]butanoic acid Openeye Name: 4-(3,4-dimethoxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid CAS Name: 4-(3,4-dimethoxyphenyl)-2-[(2,2,2-trifluoro-1-oxoethyl)amino]butanoic acid IUPAC Name: 4-(3,4-dimethoxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]butanoic acid Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[(2,2,2-trifluoroacetyl)amino]butyric acid Formula: C14H16F3NO5 MolecularWeight: 335.27575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(C(=O)O)NC(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(C(=O)O)NC(=O)C(F)(F)F)OC

InChI

InChI=1S/C14H16F3NO5/c1-22-10-6-4-8(7-11(10)23-2)3-5-9(12(19)20)18-13(21)14(15,16)17/h4,6-7,9H,3,5H2,1-2H3,(H,18,21)(H,19,20)