N-[3H-benzimidazol-5-yl(phenyl)methyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[3H-benzimidazol-5-yl(phenyl)methyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-hydroxy-4-nitro-benzamide Formula: C21H16N4O4 MolecularWeight: 388.37614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC3=C(C=C2)N=CN3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC3=C(C=C2)N=CN3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C21H16N4O4/c26-19-11-15(7-9-18(19)25(28)29)21(27)24-20(13-4-2-1-3-5-13)14-6-8-16-17(10-14)23-12-22-16/h1-12,20,26H,(H,22,23)(H,24,27)