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

Systemtic Name: 3-cyano-N-[4-(6-nitro-1-oxidanyl-benzimidazol-2-yl)phenyl]benzamide Openeye Name: 3-cyano-N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]benzamide CAS Name: 3-cyano-N-[4-(1-hydroxy-6-nitro-2-benzimidazolyl)phenyl]benzamide IUPAC Name: 3-cyano-N-[4-(1-hydroxy-6-nitrobenzimidazol-2-yl)phenyl]benzamide Traditional Name: 3-cyano-N-[4-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]benzamide Formula: C21H13N5O4 MolecularWeight: 399.35902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C21H13N5O4/c22-12-13-2-1-3-15(10-13)21(27)23-16-6-4-14(5-7-16)20-24-18-9-8-17(26(29)30)11-19(18)25(20)28/h1-11,28H,(H,23,27)