N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-4-methyl-benzamide

Systemtic Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-4-methyl-benzamide Openeye Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-4-methyl-benzamide CAS Name: N-[2-[2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]ethyl]-1-methyl-5-benzimidazolyl]-4-methylbenzamide IUPAC Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methylbenzimidazol-5-yl]-4-methylbenzamide Traditional Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-4-methyl-benzamide Formula: C28H31FN5O+ MolecularWeight: 472.577043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCN(CC4)C5=CC=C(C=C5)F)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCN(CC4)C5=CC=C(C=C5)F)C

InChI

InChI=1S/C28H30FN5O/c1-20-3-5-21(6-4-20)28(35)30-23-9-12-26-25(19-23)31-27(32(26)2)13-14-33-15-17-34(18-16-33)24-10-7-22(29)8-11-24/h3-12,19H,13-18H2,1-2H3,(H,30,35)/p+1