2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-cyclopentyl-ethanamide

Systemtic Name: 2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-cyclopentyl-ethanamide Openeye Name: 2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-cyclopentyl-acetamide CAS Name: 2-[(3S)-3-(1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]-N-cyclopentylacetamide IUPAC Name: 2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-cyclopentylacetamide Traditional Name: 2-[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]-N-cyclopentyl-acetamide Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C[NH+]2CCCC(C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CCC(C1)NC(=O)C[NH+]2CCC[C@@H](C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H26N4O/c24-18(20-15-7-1-2-8-15)13-23-11-5-6-14(12-23)19-21-16-9-3-4-10-17(16)22-19/h3-4,9-10,14-15H,1-2,5-8,11-13H2,(H,20,24)(H,21,22)/p+1/t14-/m0/s1