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

Systemtic Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]-2-phenoxy-ethanamide Openeye Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]-2-phenoxy-acetamide CAS Name: N-[2-(4-morpholin-4-iumylmethyl)-1-propyl-5-benzimidazolyl]-2-phenoxyacetamide IUPAC Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propylbenzimidazol-5-yl]-2-phenoxyacetamide Traditional Name: N-[2-(morpholin-4-ium-4-ylmethyl)-1-propyl-benzimidazol-5-yl]-2-phenoxy-acetamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1C[NH+]4CCOCC4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1C[NH+]4CCOCC4

InChI

InChI=1S/C23H28N4O3/c1-2-10-27-21-9-8-18(24-23(28)17-30-19-6-4-3-5-7-19)15-20(21)25-22(27)16-26-11-13-29-14-12-26/h3-9,15H,2,10-14,16-17H2,1H3,(H,24,28)/p+1