2-(5-methyl-2-propan-2-yl-phenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]ethanamide Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[1-methyl-2-(1-pyrrolidin-1-iumylmethyl)-5-benzimidazolyl]acetamide IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[1-methyl-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazol-5-yl]acetamide Formula: C25H33N4O2+ MolecularWeight: 421.55512

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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)C[NH+]4CCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC3=C(C=C2)N(C(=N3)C[NH+]4CCCC4)C

InChI

InChI=1S/C25H32N4O2/c1-17(2)20-9-7-18(3)13-23(20)31-16-25(30)26-19-8-10-22-21(14-19)27-24(28(22)4)15-29-11-5-6-12-29/h7-10,13-14,17H,5-6,11-12,15-16H2,1-4H3,(H,26,30)/p+1