1-methyl-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid

Systemtic Name: 1-methyl-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid Openeye Name: 1-methyl-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid CAS Name: 1-methyl-5-(trifluoromethylsulfonylamino)-2-indolecarboxylic acid IUPAC Name: 1-methyl-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid Traditional Name: 1-methyl-5-(triflylamino)indole-2-carboxylic acid Formula: C11H9F3N2O4S MolecularWeight: 322.26037

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C(F)(F)F)C=C1C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C(F)(F)F)C=C1C(=O)O

InChI

InChI=1S/C11H9F3N2O4S/c1-16-8-3-2-7(15-21(19,20)11(12,13)14)4-6(8)5-9(16)10(17)18/h2-5,15H,1H3,(H,17,18)