6-bromanyl-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborinin-4-one

Systemtic Name: 6-bromanyl-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborinin-4-one Openeye Name: 6-bromo-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborinin-4-one CAS Name: 6-bromo-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborin-4-one IUPAC Name: 6-bromo-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborinin-4-one Traditional Name: 6-bromo-2-phenyl-1,3-dihydro-1,3,2-benzodiazaborin-4-one Formula: C13H10BBrN2O MolecularWeight: 300.9463

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Descriptors Computed from Structure

Canonical SMILES:

B1(NC2=C(C=C(C=C2)Br)C(=O)N1)C3=CC=CC=C3

Isomeric SMILES

B1(NC2=C(C=C(C=C2)Br)C(=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C13H10BBrN2O/c15-10-6-7-12-11(8-10)13(18)17-14(16-12)9-4-2-1-3-5-9/h1-8,16H,(H,17,18)