2-(4-methylphenyl)sulfonyl-1-oxidanyl-6H-indeno[2,1-g][2,3,1]benzodiazaborinine

Systemtic Name: 2-(4-methylphenyl)sulfonyl-1-oxidanyl-6H-indeno[2,1-g][2,3,1]benzodiazaborinine Openeye Name: 1-hydroxy-2-(p-tolylsulfonyl)-6H-indeno[2,1-g][2,3,1]benzodiazaborinine CAS Name: 1-hydroxy-2-(4-methylphenyl)sulfonyl-6H-indeno[2,1-g][2,3,1]benzodiazaborine IUPAC Name: 1-hydroxy-2-(4-methylphenyl)sulfonyl-6H-indeno[2,1-g][2,3,1]benzodiazaborinine Traditional Name: 1-hydroxy-2-tosyl-6H-indeno[2,1-g][2,3,1]benzodiazaborine Formula: C21H17BN2O3S MolecularWeight: 388.24728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(C2=CC3=C(CC4=CC=CC=C43)C=C2C=NN1S(=O)(=O)C5=CC=C(C=C5)C)O

Isomeric SMILES

B1(C2=CC3=C(CC4=CC=CC=C43)C=C2C=NN1S(=O)(=O)C5=CC=C(C=C5)C)O

InChI

InChI=1S/C21H17BN2O3S/c1-14-6-8-18(9-7-14)28(26,27)24-22(25)21-12-20-16(11-17(21)13-23-24)10-15-4-2-3-5-19(15)20/h2-9,11-13,25H,10H2,1H3