N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-2-[(2R)-3-oxidanylidene-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-2-[(2R)-3-oxidanylidene-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-2-[(2R)-3-oxo-1-(2-pyridylmethyl)piperazin-1-ium-2-yl]acetamide CAS Name: N-[[1-(4-morpholin-4-iumyl)cyclopentyl]methyl]-2-[(2R)-3-oxo-1-(2-pyridinylmethyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]-2-[(2R)-3-oxo-1-(pyridin-2-ylmethyl)piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(2-pyridylmethyl)piperazin-1-ium-2-yl]-N-[(1-morpholin-4-ium-4-ylcyclopentyl)methyl]acetamide Formula: C22H35N5O3+2 MolecularWeight: 417.545

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CNC(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC=N3)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(C1)(CNC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC=N3)[NH+]4CCOCC4

InChI

InChI=1S/C22H33N5O3/c28-20(25-17-22(6-2-3-7-22)27-11-13-30-14-12-27)15-19-21(29)24-9-10-26(19)16-18-5-1-4-8-23-18/h1,4-5,8,19H,2-3,6-7,9-17H2,(H,24,29)(H,25,28)/p+2/t19-/m1/s1