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

Systemtic Name: N-[1-[4-(2-hydroxyethyl)cyclohexyl]-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]-3-nitro-benzamide Openeye Name: N-[1-[4-(2-hydroxyethyl)cyclohexyl]-5-(1-piperidylmethyl)benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[1-[4-(2-hydroxyethyl)cyclohexyl]-5-(1-piperidinylmethyl)-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-[4-(2-hydroxyethyl)cyclohexyl]-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[1-[4-(2-hydroxyethyl)cyclohexyl]-5-(piperidinomethyl)benzimidazol-2-yl]-3-nitro-benzamide Formula: C28H35N5O4 MolecularWeight: 505.6086

Click to see the large picture

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)CCO

Isomeric SMILES

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

InChI

InChI=1S/C28H35N5O4/c34-16-13-20-7-10-23(11-8-20)32-26-12-9-21(19-31-14-2-1-3-15-31)17-25(26)29-28(32)30-27(35)22-5-4-6-24(18-22)33(36)37/h4-6,9,12,17-18,20,23,34H,1-3,7-8,10-11,13-16,19H2,(H,29,30,35)