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

Systemtic Name: 3-nitro-N-[1-(4-oxidanylcyclohexyl)-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]benzamide Openeye Name: N-[1-(4-hydroxycyclohexyl)-5-(1-piperidylmethyl)benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[1-(4-hydroxycyclohexyl)-5-(1-piperidinylmethyl)-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-(4-hydroxycyclohexyl)-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[1-(4-hydroxycyclohexyl)-5-(piperidinomethyl)benzimidazol-2-yl]-3-nitro-benzamide Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5CCC(CC5)O

Isomeric SMILES

C1CCN(CC1)CC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5CCC(CC5)O

InChI

InChI=1S/C26H31N5O4/c32-22-10-8-20(9-11-22)30-24-12-7-18(17-29-13-2-1-3-14-29)15-23(24)27-26(30)28-25(33)19-5-4-6-21(16-19)31(34)35/h4-7,12,15-16,20,22,32H,1-3,8-11,13-14,17H2,(H,27,28,33)