2-[4-(6-chloranyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N,N-diphenyl-ethanamide

Systemtic Name: 2-[4-(6-chloranyl-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N,N-diphenyl-ethanamide Openeye Name: 2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N,N-diphenyl-acetamide CAS Name: 2-[4-(6-chloro-1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]-N,N-diphenylacetamide IUPAC Name: 2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N,N-diphenylacetamide Traditional Name: 2-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N,N-diphenyl-acetamide Formula: C26H26ClN4O+ MolecularWeight: 445.96384

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=C(N2)C=C(C=C3)Cl)CC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=C(N2)C=C(C=C3)Cl)CC(=O)N(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25ClN4O/c27-20-11-12-23-24(17-20)29-26(28-23)19-13-15-30(16-14-19)18-25(32)31(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-12,17,19H,13-16,18H2,(H,28,29)/p+1