3-(4-methylpyridin-2-yl)-3-oxidanylidene-2-[5-(trifluoromethyloxy)-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-(4-methylpyridin-2-yl)-3-oxidanylidene-2-[5-(trifluoromethyloxy)-1H-indol-3-yl]propanoic acid Openeye Name: 3-(4-methyl-2-pyridyl)-3-oxo-2-[5-(trifluoromethoxy)-1H-indol-3-yl]propanoic acid CAS Name: 3-(4-methyl-2-pyridinyl)-3-oxo-2-[5-(trifluoromethoxy)-1H-indol-3-yl]propanoic acid IUPAC Name: 3-(4-methylpyridin-2-yl)-3-oxo-2-[5-(trifluoromethoxy)-1H-indol-3-yl]propanoic acid Traditional Name: 3-keto-3-(4-methyl-2-pyridyl)-2-[5-(trifluoromethoxy)-1H-indol-3-yl]propionic acid Formula: C18H13F3N2O4 MolecularWeight: 378.30203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)C(C2=CNC3=C2C=C(C=C3)OC(F)(F)F)C(=O)O

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)C(C2=CNC3=C2C=C(C=C3)OC(F)(F)F)C(=O)O

InChI

InChI=1S/C18H13F3N2O4/c1-9-4-5-22-14(6-9)16(24)15(17(25)26)12-8-23-13-3-2-10(7-11(12)13)27-18(19,20)21/h2-8,15,23H,1H3,(H,25,26)