methyl 2-iodanyl-1-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: methyl 2-iodanyl-1-(phenylsulfonyl)indole-3-carboxylate Openeye Name: methyl 1-(benzenesulfonyl)-2-iodo-indole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-2-iodo-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(benzenesulfonyl)-2-iodoindole-3-carboxylate Traditional Name: 1-besyl-2-iodo-indole-3-carboxylic acid methyl ester Formula: C16H12INO4S MolecularWeight: 441.24025

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)I

Isomeric SMILES

COC(=O)C1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)I

InChI

InChI=1S/C16H12INO4S/c1-22-16(19)14-12-9-5-6-10-13(12)18(15(14)17)23(20,21)11-7-3-2-4-8-11/h2-10H,1H3