5,8-dimethyl-2-(4-methylphenyl)sulfonyl-1-oxidanyl-2,3,1-benzodiazaborinine

Systemtic Name: 5,8-dimethyl-2-(4-methylphenyl)sulfonyl-1-oxidanyl-2,3,1-benzodiazaborinine Openeye Name: 1-hydroxy-5,8-dimethyl-2-(p-tolylsulfonyl)-2,3,1-benzodiazaborinine CAS Name: 1-hydroxy-5,8-dimethyl-2-(4-methylphenyl)sulfonyl-2,3,1-benzodiazaborine IUPAC Name: 1-hydroxy-5,8-dimethyl-2-(4-methylphenyl)sulfonyl-2,3,1-benzodiazaborinine Traditional Name: 1-hydroxy-5,8-dimethyl-2-tosyl-2,3,1-benzodiazaborine Formula: C16H17BN2O3S MolecularWeight: 328.19378

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=CC(=C2C=NN1S(=O)(=O)C3=CC=C(C=C3)C)C)C)O

Isomeric SMILES

B1(C2=C(C=CC(=C2C=NN1S(=O)(=O)C3=CC=C(C=C3)C)C)C)O

InChI

InChI=1S/C16H17BN2O3S/c1-11-4-8-14(9-5-11)23(21,22)19-17(20)16-13(3)7-6-12(2)15(16)10-18-19/h4-10,20H,1-3H3