N-[5-fluoranyl-1-[4-(3-nitrophenyl)carbonylcyclohexyl]benzimidazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[5-fluoranyl-1-[4-(3-nitrophenyl)carbonylcyclohexyl]benzimidazol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-fluoro-1-[4-(3-nitrobenzoyl)cyclohexyl]benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[5-fluoro-1-[4-[(3-nitrophenyl)-oxomethyl]cyclohexyl]-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[5-fluoro-1-[4-(3-nitrobenzoyl)cyclohexyl]benzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-fluoro-1-[4-(3-nitrobenzoyl)cyclohexyl]benzimidazol-2-yl]-3-nitro-benzamide Formula: C27H22FN5O6 MolecularWeight: 531.491883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3C4=C(C=C(C=C4)F)N=C3NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC(CCC1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])N3C4=C(C=C(C=C4)F)N=C3NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H22FN5O6/c28-19-9-12-24-23(15-19)29-27(30-26(35)18-4-2-6-22(14-18)33(38)39)31(24)20-10-7-16(8-11-20)25(34)17-3-1-5-21(13-17)32(36)37/h1-6,9,12-16,20H,7-8,10-11H2,(H,29,30,35)