3-[4-methoxy-3-[[3-[3-(trifluoromethyl)phenyl]prop-2-ynoylamino]methyl]phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[4-methoxy-3-[[3-[3-(trifluoromethyl)phenyl]prop-2-ynoylamino]methyl]phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-isopropoxy-3-[4-methoxy-3-[[3-[3-(trifluoromethyl)phenyl]prop-2-ynoylamino]methyl]phenyl]propanoic acid CAS Name: 3-[4-methoxy-3-[[[1-oxo-3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]amino]methyl]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[4-methoxy-3-[[3-[3-(trifluoromethyl)phenyl]prop-2-ynoylamino]methyl]phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-isopropoxy-3-[4-methoxy-3-[[[3-[3-(trifluoromethyl)phenyl]propioloyl]amino]methyl]phenyl]propionic acid Formula: C24H24F3NO5 MolecularWeight: 463.44627

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C#CC2=CC(=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C#CC2=CC(=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C24H24F3NO5/c1-15(2)33-21(23(30)31)13-17-7-9-20(32-3)18(11-17)14-28-22(29)10-8-16-5-4-6-19(12-16)24(25,26)27/h4-7,9,11-12,15,21H,13-14H2,1-3H3,(H,28,29)(H,30,31)