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

Systemtic Name: N-[1-(3-fluorophenyl)-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]-3-nitro-benzamide Openeye Name: N-[1-(3-fluorophenyl)-5-(1-piperidylmethyl)benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[1-(3-fluorophenyl)-5-(1-piperidinylmethyl)-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-(3-fluorophenyl)-5-(piperidin-1-ylmethyl)benzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[1-(3-fluorophenyl)-5-(piperidinomethyl)benzimidazol-2-yl]-3-nitro-benzamide Formula: C26H24FN5O3 MolecularWeight: 473.498863

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-])C5=CC(=CC=C5)F

Isomeric SMILES

C1CCN(CC1)CC2=CC3=C(C=C2)N(C(=N3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC(=CC=C5)F

InChI

InChI=1S/C26H24FN5O3/c27-20-7-5-8-21(16-20)31-24-11-10-18(17-30-12-2-1-3-13-30)14-23(24)28-26(31)29-25(33)19-6-4-9-22(15-19)32(34)35/h4-11,14-16H,1-3,12-13,17H2,(H,28,29,33)