N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]pentanamide

Systemtic Name: N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]pentanamide Openeye Name: N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]pentanamide CAS Name: N-[1-methyl-2-(4-morpholin-4-iumylmethyl)-5-benzimidazolyl]pentanamide IUPAC Name: N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]pentanamide Traditional Name: N-[1-methyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]valeramide Formula: C18H27N4O2+ MolecularWeight: 331.43258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCOCC3)C

Isomeric SMILES

CCCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCOCC3)C

InChI

InChI=1S/C18H26N4O2/c1-3-4-5-18(23)19-14-6-7-16-15(12-14)20-17(21(16)2)13-22-8-10-24-11-9-22/h6-7,12H,3-5,8-11,13H2,1-2H3,(H,19,23)/p+1