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

Systemtic Name: 1-(cyclohexylmethyl)-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid Openeye Name: 1-(cyclohexylmethyl)-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid CAS Name: 1-(cyclohexylmethyl)-5-(trifluoromethylsulfonylamino)-2-indolecarboxylic acid IUPAC Name: 1-(cyclohexylmethyl)-5-(trifluoromethylsulfonylamino)indole-2-carboxylic acid Traditional Name: 1-(cyclohexylmethyl)-5-(triflylamino)indole-2-carboxylic acid Formula: C17H19F3N2O4S MolecularWeight: 404.40397

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=C(C=C(C=C3)NS(=O)(=O)C(F)(F)F)C=C2C(=O)O

Isomeric SMILES

C1CCC(CC1)CN2C3=C(C=C(C=C3)NS(=O)(=O)C(F)(F)F)C=C2C(=O)O

InChI

InChI=1S/C17H19F3N2O4S/c18-17(19,20)27(25,26)21-13-6-7-14-12(8-13)9-15(16(23)24)22(14)10-11-4-2-1-3-5-11/h6-9,11,21H,1-5,10H2,(H,23,24)