4-[[4-(benzimidazol-1-ylcarbonyl)-2,6-dinitro-phenyl]amino]-N-(1H-benzimidazol-2-ylmethyl)benzamide

Systemtic Name: 4-[[4-(benzimidazol-1-ylcarbonyl)-2,6-dinitro-phenyl]amino]-N-(1H-benzimidazol-2-ylmethyl)benzamide Openeye Name: 4-[4-(benzimidazole-1-carbonyl)-2,6-dinitro-anilino]-N-(1H-benzimidazol-2-ylmethyl)benzamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-4-[4-[1-benzimidazolyl(oxo)methyl]-2,6-dinitroanilino]benzamide IUPAC Name: 4-[4-(benzimidazole-1-carbonyl)-2,6-dinitroanilino]-N-(1H-benzimidazol-2-ylmethyl)benzamide Traditional Name: 4-[4-(benzimidazole-1-carbonyl)-2,6-dinitro-anilino]-N-(1H-benzimidazol-2-ylmethyl)benzamide Formula: C29H20N8O6 MolecularWeight: 576.5191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC(=O)C3=CC=C(C=C3)NC4=C(C=C(C=C4[N+](=O)[O-])C(=O)N5C=NC6=CC=CC=C65)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC(=O)C3=CC=C(C=C3)NC4=C(C=C(C=C4[N+](=O)[O-])C(=O)N5C=NC6=CC=CC=C65)[N+](=O)[O-]

InChI

InChI=1S/C29H20N8O6/c38-28(30-15-26-33-20-5-1-2-6-21(20)34-26)17-9-11-19(12-10-17)32-27-24(36(40)41)13-18(14-25(27)37(42)43)29(39)35-16-31-22-7-3-4-8-23(22)35/h1-14,16,32H,15H2,(H,30,38)(H,33,34)