N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-acetamidophenyl)-2-[4-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetamide Formula: C22H26N5O2+ MolecularWeight: 392.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)C[NH+]2CCC(CC2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H25N5O2/c1-15(28)23-17-5-4-6-18(13-17)24-21(29)14-27-11-9-16(10-12-27)22-25-19-7-2-3-8-20(19)26-22/h2-8,13,16H,9-12,14H2,1H3,(H,23,28)(H,24,29)(H,25,26)/p+1