5-methyl-1-(phenylmethyl)-3-sulfamoyl-4-(trifluoromethyl)indole-2-carboxylic acid

Systemtic Name: 5-methyl-1-(phenylmethyl)-3-sulfamoyl-4-(trifluoromethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-5-methyl-3-sulfamoyl-4-(trifluoromethyl)indole-2-carboxylic acid CAS Name: 5-methyl-1-(phenylmethyl)-3-sulfamoyl-4-(trifluoromethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-5-methyl-3-sulfamoyl-4-(trifluoromethyl)indole-2-carboxylic acid Traditional Name: 1-benzyl-5-methyl-3-sulfamoyl-4-(trifluoromethyl)indole-2-carboxylic acid Formula: C18H15F3N2O4S MolecularWeight: 412.38291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N(C(=C2S(=O)(=O)N)C(=O)O)CC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C2=C(C=C1)N(C(=C2S(=O)(=O)N)C(=O)O)CC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H15F3N2O4S/c1-10-7-8-12-13(14(10)18(19,20)21)16(28(22,26)27)15(17(24)25)23(12)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,24,25)(H2,22,26,27)