2-(2,4,6-trimethylphenyl)-1,3-dihydro-1,3,2-benzodiazaborinin-4-one

Systemtic Name: 2-(2,4,6-trimethylphenyl)-1,3-dihydro-1,3,2-benzodiazaborinin-4-one Openeye Name: 2-(2,4,6-trimethylphenyl)-1,3-dihydro-1,3,2-benzodiazaborinin-4-one CAS Name: 2-(2,4,6-trimethylphenyl)-1,3-dihydro-1,3,2-benzodiazaborin-4-one IUPAC Name: 2-(2,4,6-trimethylphenyl)-1,3-dihydro-1,3,2-benzodiazaborinin-4-one Traditional Name: 2-mesityl-1,3-dihydro-1,3,2-benzodiazaborin-4-one Formula: C16H17BN2O MolecularWeight: 264.12998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B1(NC2=CC=CC=C2C(=O)N1)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

B1(NC2=CC=CC=C2C(=O)N1)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C16H17BN2O/c1-10-8-11(2)15(12(3)9-10)17-18-14-7-5-4-6-13(14)16(20)19-17/h4-9,18H,1-3H3,(H,19,20)