N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]acetamide CAS Name: N-[1-methyl-2-[2-(4-morpholin-4-iumyl)ethyl]-5-benzimidazolyl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]-2-(5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[1-methyl-2-(2-morpholin-4-ium-4-ylethyl)benzimidazol-5-yl]acetamide Formula: C26H35N4O3+ MolecularWeight: 451.5811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCOCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)CC[NH+]4CCOCC4)C

InChI

InChI=1S/C26H34N4O3/c1-18(2)21-7-5-19(3)15-24(21)33-17-26(31)27-20-6-8-23-22(16-20)28-25(29(23)4)9-10-30-11-13-32-14-12-30/h5-8,15-16,18H,9-14,17H2,1-4H3,(H,27,31)/p+1