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

Systemtic Name: N-[2-[(4-ethanoylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]ethanamide Openeye Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]acetamide CAS Name: N-[2-[(4-acetyl-1-piperazin-1-iumyl)methyl]-1-methyl-5-benzimidazolyl]acetamide IUPAC Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methylbenzimidazol-5-yl]acetamide Traditional Name: N-[2-[(4-acetylpiperazin-1-ium-1-yl)methyl]-1-methyl-benzimidazol-5-yl]acetamide Formula: C17H24N5O2+ MolecularWeight: 330.40476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C17H23N5O2/c1-12(23)18-14-4-5-16-15(10-14)19-17(20(16)3)11-21-6-8-22(9-7-21)13(2)24/h4-5,10H,6-9,11H2,1-3H3,(H,18,23)/p+1