3-morpholin-4-ylcarbonyl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid

Systemtic Name: 3-morpholin-4-ylcarbonyl-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Openeye Name: 3-(morpholine-4-carbonyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid CAS Name: 3-[4-morpholinyl(oxo)methyl]-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolecarboxylic acid IUPAC Name: 3-(morpholine-4-carbonyl)-1-[[3-(trifluoromethyl)phenyl]methyl]indole-2-carboxylic acid Traditional Name: 3-(morpholine-4-carbonyl)-1-[3-(trifluoromethyl)benzyl]indole-2-carboxylic acid Formula: C22H19F3N2O4 MolecularWeight: 432.39247

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

Isomeric SMILES

C1COCCN1C(=O)C2=C(N(C3=CC=CC=C32)CC4=CC(=CC=C4)C(F)(F)F)C(=O)O

InChI

InChI=1S/C22H19F3N2O4/c23-22(24,25)15-5-3-4-14(12-15)13-27-17-7-2-1-6-16(17)18(19(27)21(29)30)20(28)26-8-10-31-11-9-26/h1-7,12H,8-11,13H2,(H,29,30)