2-[(3R)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(3R)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[(3R)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-benzyl-acetamide CAS Name: 2-[(3R)-3-(1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[(3R)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-benzylacetamide Traditional Name: 2-[(3R)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-benzyl-acetamide Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC(=O)NCC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC(=O)NCC2=CC=CC=C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N4O/c26-20(22-13-16-7-2-1-3-8-16)15-25-12-6-9-17(14-25)21-23-18-10-4-5-11-19(18)24-21/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,22,26)(H,23,24)/p+1/t17-/m1/s1