tert-butyl 3-(2-acetyloxyethyl)-2-iodanyl-6-methylsulfonyloxy-indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-acetyloxyethyl)-2-iodanyl-6-methylsulfonyloxy-indole-1-carboxylate Openeye Name: tert-butyl 3-(2-acetoxyethyl)-2-iodo-6-methylsulfonyloxy-indole-1-carboxylate CAS Name: 3-(2-acetyloxyethyl)-2-iodo-6-methylsulfonyloxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-acetyloxyethyl)-2-iodo-6-methylsulfonyloxyindole-1-carboxylate Traditional Name: 3-(2-acetoxyethyl)-2-iodo-6-methylsulfonyloxy-indole-1-carboxylic acid tert-butyl ester Formula: C18H22INO7S MolecularWeight: 523.33925

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1=C(N(C2=C1C=CC(=C2)OS(=O)(=O)C)C(=O)OC(C)(C)C)I

Isomeric SMILES

CC(=O)OCCC1=C(N(C2=C1C=CC(=C2)OS(=O)(=O)C)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C18H22INO7S/c1-11(21)25-9-8-14-13-7-6-12(27-28(5,23)24)10-15(13)20(16(14)19)17(22)26-18(2,3)4/h6-7,10H,8-9H2,1-5H3