N-(1-bromanyl-4-nitro-isoquinolin-3-yl)benzamide

Systemtic Name: N-(1-bromanyl-4-nitro-isoquinolin-3-yl)benzamide Openeye Name: N-(1-bromo-4-nitro-3-isoquinolyl)benzamide CAS Name: N-(1-bromo-4-nitro-3-isoquinolinyl)benzamide IUPAC Name: N-(1-bromo-4-nitroisoquinolin-3-yl)benzamide Traditional Name: N-(1-bromo-4-nitro-3-isoquinolyl)benzamide Formula: C16H10BrN3O3 MolecularWeight: 372.1729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(C3=CC=CC=C3C(=N2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(C3=CC=CC=C3C(=N2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H10BrN3O3/c17-14-12-9-5-4-8-11(12)13(20(22)23)15(18-14)19-16(21)10-6-2-1-3-7-10/h1-9H,(H,18,19,21)