N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)CC)N=C1C[NH+]3CCOCC3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)CC)N=C1C[NH+]3CCOCC3

InChI

InChI=1S/C18H26N4O2/c1-3-7-22-16-6-5-14(19-18(23)4-2)12-15(16)20-17(22)13-21-8-10-24-11-9-21/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,19,23)/p+1