N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]cyclohexanecarboxamide

Systemtic Name: N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]cyclohexanecarboxamide Openeye Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]cyclohexanecarboxamide CAS Name: N-[2-[(4-acetyl-1-piperazin-1-iumyl)methyl]-1-methyl-5-benzimidazolyl]cyclohexanecarboxamide IUPAC Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]cyclohexanecarboxamide Traditional Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]cyclohexanecarboxamide Formula: C22H32N5O2+ MolecularWeight: 398.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4CCCCC4

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC2=NC3=C(N2C)C=CC(=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C22H31N5O2/c1-16(28)27-12-10-26(11-13-27)15-21-24-19-14-18(8-9-20(19)25(21)2)23-22(29)17-6-4-3-5-7-17/h8-9,14,17H,3-7,10-13,15H2,1-2H3,(H,23,29)/p+1