N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]-2-phenoxy-acetamide CAS Name: N-[1-ethyl-2-(4-morpholin-4-iumylmethyl)-5-benzimidazolyl]-2-phenoxyacetamide IUPAC Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]-2-phenoxyacetamide Traditional Name: N-[1-ethyl-2-(morpholin-4-ium-4-ylmethyl)benzimidazol-5-yl]-2-phenoxy-acetamide Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1C[NH+]4CCOCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1C[NH+]4CCOCC4

InChI

InChI=1S/C22H26N4O3/c1-2-26-20-9-8-17(23-22(27)16-29-18-6-4-3-5-7-18)14-19(20)24-21(26)15-25-10-12-28-13-11-25/h3-9,14H,2,10-13,15-16H2,1H3,(H,23,27)/p+1