(7-isocyano-4-oxidanylidene-1H-quinazolin-5-yl)boronic acid

Systemtic Name: (7-isocyano-4-oxidanylidene-1H-quinazolin-5-yl)boronic acid Openeye Name: (7-isocyano-4-oxo-1H-quinazolin-5-yl)boronic acid CAS Name: (7-isocyano-4-oxo-1H-quinazolin-5-yl)boronic acid IUPAC Name: (7-isocyano-4-oxo-1H-quinazolin-5-yl)boronic acid Traditional Name: (7-isocyano-4-keto-1H-quinazolin-5-yl)boronic acid Formula: C9H6BN3O3 MolecularWeight: 214.97324

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC2=C1C(=O)N=CN2)[N+]#[C-])(O)O

Isomeric SMILES

B(C1=CC(=CC2=C1C(=O)N=CN2)[N+]#[C-])(O)O

InChI

InChI=1S/C9H6BN3O3/c1-11-5-2-6(10(15)16)8-7(3-5)12-4-13-9(8)14/h2-4,15-16H,(H,12,13,14)