N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-ethanamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-acetamide CAS Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]-N-methylacetamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-[(2R)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C21H30N5O2+ MolecularWeight: 384.4952

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=NC2=CC=CC=C2N1)C(=O)CC3C(=O)NCC[NH+]3C4CCCC4

Isomeric SMILES

CN(CCC1=NC2=CC=CC=C2N1)C(=O)C[C@@H]3C(=O)NCC[NH+]3C4CCCC4

InChI

InChI=1S/C21H29N5O2/c1-25(12-10-19-23-16-8-4-5-9-17(16)24-19)20(27)14-18-21(28)22-11-13-26(18)15-6-2-3-7-15/h4-5,8-9,15,18H,2-3,6-7,10-14H2,1H3,(H,22,28)(H,23,24)/p+1/t18-/m1/s1