[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]boronic acid

Systemtic Name: [6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]boronic acid Openeye Name: [6-bromo-1-(p-tolylsulfonyl)indol-3-yl]boronic acid CAS Name: [6-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]boronic acid IUPAC Name: [6-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]boronic acid Traditional Name: (6-bromo-1-tosyl-indol-3-yl)boronic acid Formula: C15H13BBrNO4S MolecularWeight: 394.04802

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CN(C2=C1C=CC(=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C)(O)O

Isomeric SMILES

B(C1=CN(C2=C1C=CC(=C2)Br)S(=O)(=O)C3=CC=C(C=C3)C)(O)O

InChI

InChI=1S/C15H13BBrNO4S/c1-10-2-5-12(6-3-10)23(21,22)18-9-14(16(19)20)13-7-4-11(17)8-15(13)18/h2-9,19-20H,1H3