3-nitro-N-[1-(4-oxidanylcyclohexyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzimidazol-2-yl]benzamide

Systemtic Name: 3-nitro-N-[1-(4-oxidanylcyclohexyl)-5-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzimidazol-2-yl]benzamide Openeye Name: N-[1-(4-hydroxycyclohexyl)-5-[(2-oxopyrrolidin-1-yl)methyl]benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[1-(4-hydroxycyclohexyl)-5-[(2-oxo-1-pyrrolidinyl)methyl]-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-(4-hydroxycyclohexyl)-5-[(2-oxopyrrolidin-1-yl)methyl]benzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[1-(4-hydroxycyclohexyl)-5-[(2-ketopyrrolidino)methyl]benzimidazol-2-yl]-3-nitro-benzamide Formula: C25H27N5O5 MolecularWeight: 477.51238

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5CCC(CC5)O

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5CCC(CC5)O

InChI

InChI=1S/C25H27N5O5/c31-20-9-7-18(8-10-20)29-22-11-6-16(15-28-12-2-5-23(28)32)13-21(22)26-25(29)27-24(33)17-3-1-4-19(14-17)30(34)35/h1,3-4,6,11,13-14,18,20,31H,2,5,7-10,12,15H2,(H,26,27,33)