2-methyl-2-[[6-(pyridin-3-ylmethoxy)-1-(trifluoromethyl)naphthalen-2-yl]carbonylamino]propanoic acid

Systemtic Name: 2-methyl-2-[[6-(pyridin-3-ylmethoxy)-1-(trifluoromethyl)naphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: 2-methyl-2-[[6-(3-pyridylmethoxy)-1-(trifluoromethyl)naphthalene-2-carbonyl]amino]propanoic acid CAS Name: 2-methyl-2-[[oxo-[6-(3-pyridinylmethoxy)-1-(trifluoromethyl)-2-naphthalenyl]methyl]amino]propanoic acid IUPAC Name: 2-methyl-2-[[6-(pyridin-3-ylmethoxy)-1-(trifluoromethyl)naphthalene-2-carbonyl]amino]propanoic acid Traditional Name: 2-methyl-2-[[6-(3-pyridylmethoxy)-1-(trifluoromethyl)-2-naphthoyl]amino]propionic acid Formula: C22H19F3N2O4 MolecularWeight: 432.39247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C1=C(C2=C(C=C1)C=C(C=C2)OCC3=CN=CC=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=C(C=C1)C=C(C=C2)OCC3=CN=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H19F3N2O4/c1-21(2,20(29)30)27-19(28)17-7-5-14-10-15(31-12-13-4-3-9-26-11-13)6-8-16(14)18(17)22(23,24)25/h3-11H,12H2,1-2H3,(H,27,28)(H,29,30)