2-[[4-methoxy-3-[2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]phenyl]methyl]butanoic acid

Systemtic Name: 2-[[4-methoxy-3-[2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl]phenyl]methyl]butanoic acid Openeye Name: 2-[[4-methoxy-3-[2-[2-methyl-3-(trifluoromethyl)anilino]-2-oxo-ethyl]phenyl]methyl]butanoic acid CAS Name: 2-[[4-methoxy-3-[2-[2-methyl-3-(trifluoromethyl)anilino]-2-oxoethyl]phenyl]methyl]butanoic acid IUPAC Name: 2-[[4-methoxy-3-[2-[2-methyl-3-(trifluoromethyl)anilino]-2-oxoethyl]phenyl]methyl]butanoic acid Traditional Name: 2-[3-[2-keto-2-[2-methyl-3-(trifluoromethyl)anilino]ethyl]-4-methoxy-benzyl]butyric acid Formula: C22H24F3NO4 MolecularWeight: 423.42547

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=C(C=C1)OC)CC(=O)NC2=CC=CC(=C2C)C(F)(F)F)C(=O)O

Isomeric SMILES

CCC(CC1=CC(=C(C=C1)OC)CC(=O)NC2=CC=CC(=C2C)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H24F3NO4/c1-4-15(21(28)29)10-14-8-9-19(30-3)16(11-14)12-20(27)26-18-7-5-6-17(13(18)2)22(23,24)25/h5-9,11,15H,4,10,12H2,1-3H3,(H,26,27)(H,28,29)