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

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-4-[(4-morpholin-4-ylcarbonyl-2,6-dinitro-phenyl)amino]benzamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-4-[4-(morpholine-4-carbonyl)-2,6-dinitro-anilino]benzamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-4-[4-[4-morpholinyl(oxo)methyl]-2,6-dinitroanilino]benzamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-4-[4-(morpholine-4-carbonyl)-2,6-dinitroanilino]benzamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-4-[4-(morpholine-4-carbonyl)-2,6-dinitro-anilino]benzamide Formula: C26H23N7O7 MolecularWeight: 545.50352

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])NC3=CC=C(C=C3)C(=O)NCC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])NC3=CC=C(C=C3)C(=O)NCC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

InChI

InChI=1S/C26H23N7O7/c34-25(27-15-23-29-19-3-1-2-4-20(19)30-23)16-5-7-18(8-6-16)28-24-21(32(36)37)13-17(14-22(24)33(38)39)26(35)31-9-11-40-12-10-31/h1-8,13-14,28H,9-12,15H2,(H,27,34)(H,29,30)