3-(benzimidazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(benzimidazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(benzimidazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(1-benzimidazolyl)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(benzimidazol-1-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(benzimidazol-1-yl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]propionamide Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)CCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O2/c27-22(9-10-26-17-24-20-7-3-4-8-21(20)26)23-15-18-5-1-2-6-19(18)16-25-11-13-28-14-12-25/h1-8,17H,9-16H2,(H,23,27)/p+1