2-(4-methylphenyl)sulfonyl-1-oxidanyl-2,3,1-benzodiazaborinin-6-amine

Systemtic Name: 2-(4-methylphenyl)sulfonyl-1-oxidanyl-2,3,1-benzodiazaborinin-6-amine Openeye Name: 1-hydroxy-2-(p-tolylsulfonyl)-2,3,1-benzodiazaborinin-6-amine CAS Name: 1-hydroxy-2-(4-methylphenyl)sulfonyl-2,3,1-benzodiazaborin-6-amine IUPAC Name: 1-hydroxy-2-(4-methylphenyl)sulfonyl-2,3,1-benzodiazaborinin-6-amine Traditional Name: (1-hydroxy-2-tosyl-2,3,1-benzodiazaborin-6-yl)amine Formula: C14H14BN3O3S MolecularWeight: 315.15526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14BN3O3S/c1-10-2-5-13(6-3-10)22(20,21)18-15(19)14-7-4-12(16)8-11(14)9-17-18/h2-9,19H,16H2,1H3