N-(4-cyano-7-nitro-1-oxidanylidene-2-phenyl-isoquinolin-3-yl)benzamide

Systemtic Name: N-(4-cyano-7-nitro-1-oxidanylidene-2-phenyl-isoquinolin-3-yl)benzamide Openeye Name: N-(4-cyano-7-nitro-1-oxo-2-phenyl-3-isoquinolyl)benzamide CAS Name: N-(4-cyano-7-nitro-1-oxo-2-phenyl-3-isoquinolinyl)benzamide IUPAC Name: N-(4-cyano-7-nitro-1-oxo-2-phenylisoquinolin-3-yl)benzamide Traditional Name: N-(4-cyano-1-keto-7-nitro-2-phenyl-3-isoquinolyl)benzamide Formula: C23H14N4O4 MolecularWeight: 410.38166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H14N4O4/c24-14-20-18-12-11-17(27(30)31)13-19(18)23(29)26(16-9-5-2-6-10-16)21(20)25-22(28)15-7-3-1-4-8-15/h1-13H,(H,25,28)