[5-methoxycarbonyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]boronic acid

Systemtic Name: [5-methoxycarbonyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]boronic acid Openeye Name: [5-methoxycarbonyl-1-(p-tolylsulfonyl)indol-3-yl]boronic acid CAS Name: [5-methoxycarbonyl-1-(4-methylphenyl)sulfonyl-3-indolyl]boronic acid IUPAC Name: [5-methoxycarbonyl-1-(4-methylphenyl)sulfonylindol-3-yl]boronic acid Traditional Name: (5-carbomethoxy-1-tosyl-indol-3-yl)boronic acid Formula: C17H16BNO6S MolecularWeight: 373.18804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BNO6S/c1-11-3-6-13(7-4-11)26(23,24)19-10-15(18(21)22)14-9-12(17(20)25-2)5-8-16(14)19/h3-10,21-22H,1-2H3