3-(aminomethyl)-2-fluoranyl-3-(4-methoxyphenyl)-4-oxidanylidene-2-propoxy-4-[4-(trifluoromethyl)phenyl]butanoic acid

Systemtic Name: 3-(aminomethyl)-2-fluoranyl-3-(4-methoxyphenyl)-4-oxidanylidene-2-propoxy-4-[4-(trifluoromethyl)phenyl]butanoic acid Openeye Name: 3-(aminomethyl)-2-fluoro-3-(4-methoxyphenyl)-4-oxo-2-propoxy-4-[4-(trifluoromethyl)phenyl]butanoic acid CAS Name: 3-(aminomethyl)-2-fluoro-3-(4-methoxyphenyl)-4-oxo-2-propoxy-4-[4-(trifluoromethyl)phenyl]butanoic acid IUPAC Name: 3-(aminomethyl)-2-fluoro-3-(4-methoxyphenyl)-4-oxo-2-propoxy-4-[4-(trifluoromethyl)phenyl]butanoic acid Traditional Name: 3-(aminomethyl)-2-fluoro-4-keto-3-(4-methoxyphenyl)-2-propoxy-4-[4-(trifluoromethyl)phenyl]butyric acid Formula: C22H23F4NO5 MolecularWeight: 457.415333

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C(=O)O)(C(CN)(C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CCCOC(C(=O)O)(C(CN)(C1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C22H23F4NO5/c1-3-12-32-21(23,19(29)30)20(13-27,15-8-10-17(31-2)11-9-15)18(28)14-4-6-16(7-5-14)22(24,25)26/h4-11H,3,12-13,27H2,1-2H3,(H,29,30)