4-cyano-N-[[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]methyl]benzamide

Systemtic Name: 4-cyano-N-[[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]methyl]benzamide Openeye Name: 4-cyano-N-[[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]methyl]benzamide CAS Name: 4-cyano-N-[[4-(1-hydroxy-6-nitro-2-benzimidazolyl)phenyl]methyl]benzamide IUPAC Name: 4-cyano-N-[[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]methyl]benzamide Traditional Name: 4-cyano-N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)benzyl]benzamide Formula: C22H15N5O4 MolecularWeight: 413.3856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O4/c23-12-14-1-7-17(8-2-14)22(28)24-13-15-3-5-16(6-4-15)21-25-19-10-9-18(27(30)31)11-20(19)26(21)29/h1-11,29H,13H2,(H,24,28)