tert-butyl 2-methyl-4-(trifluoromethylsulfonyloxy)indole-1-carboxylate

Systemtic Name: tert-butyl 2-methyl-4-(trifluoromethylsulfonyloxy)indole-1-carboxylate Openeye Name: tert-butyl 2-methyl-4-(trifluoromethylsulfonyloxy)indole-1-carboxylate CAS Name: 2-methyl-4-(trifluoromethylsulfonyloxy)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-4-(trifluoromethylsulfonyloxy)indole-1-carboxylate Traditional Name: 2-methyl-4-triflyloxy-indole-1-carboxylic acid tert-butyl ester Formula: C15H16F3NO5S MolecularWeight: 379.35145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(N1C(=O)OC(C)(C)C)C=CC=C2OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C15H16F3NO5S/c1-9-8-10-11(19(9)13(20)23-14(2,3)4)6-5-7-12(10)24-25(21,22)15(16,17)18/h5-8H,1-4H3