7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzimidazole-5-carboxamide

Systemtic Name: 7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzimidazole-5-carboxamide Openeye Name: 7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzimidazole-5-carboxamide CAS Name: 7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-5-benzimidazolecarboxamide IUPAC Name: 7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)benzimidazole-5-carboxamide Traditional Name: 7-acetamido-1-ethyl-2-(2-fluorophenyl)-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)benzimidazole-5-carboxamide Formula: C26H33FN5O3+ MolecularWeight: 482.570323

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2NC(=O)C)C(=O)NCC(C)(C)[NH+]3CCOCC3)N=C1C4=CC=CC=C4F

Isomeric SMILES

CCN1C2=C(C=C(C=C2NC(=O)C)C(=O)NCC(C)(C)[NH+]3CCOCC3)N=C1C4=CC=CC=C4F

InChI

InChI=1S/C26H32FN5O3/c1-5-32-23-21(29-17(2)33)14-18(15-22(23)30-24(32)19-8-6-7-9-20(19)27)25(34)28-16-26(3,4)31-10-12-35-13-11-31/h6-9,14-15H,5,10-13,16H2,1-4H3,(H,28,34)(H,29,33)/p+1