2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one

Systemtic Name: 2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one Openeye Name: 2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one CAS Name: 2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one IUPAC Name: 2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one Traditional Name: 2-phenyl-5,6-dihydro-1,3,7,2-benzodioxazaborecin-4-one Formula: C16H14BNO3 MolecularWeight: 279.09826

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(=O)CCN=CC2=CC=CC=C2O1)C3=CC=CC=C3

Isomeric SMILES

B1(OC(=O)CCN=CC2=CC=CC=C2O1)C3=CC=CC=C3

InChI

InChI=1S/C16H14BNO3/c19-16-10-11-18-12-13-6-4-5-9-15(13)20-17(21-16)14-7-2-1-3-8-14/h1-9,12H,10-11H2