2-[1-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)cyclopentyl]ethanoate

Systemtic Name: 2-[1-(2-oxidanylidene-2-piperazin-4-ium-1-yl-ethyl)cyclopentyl]ethanoate Openeye Name: 2-[1-(2-oxo-2-piperazin-4-ium-1-yl-ethyl)cyclopentyl]acetate CAS Name: 2-[1-[2-oxo-2-(1-piperazin-4-iumyl)ethyl]cyclopentyl]acetate IUPAC Name: 2-[1-(2-oxo-2-piperazin-4-ium-1-ylethyl)cyclopentyl]acetate Traditional Name: 2-[1-(2-keto-2-piperazin-4-ium-1-yl-ethyl)cyclopentyl]acetate Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CC(=O)N2CC[NH2+]CC2)CC(=O)[O-]

Isomeric SMILES

C1CCC(C1)(CC(=O)N2CC[NH2+]CC2)CC(=O)[O-]

InChI

InChI=1S/C13H22N2O3/c16-11(15-7-5-14-6-8-15)9-13(10-12(17)18)3-1-2-4-13/h14H,1-10H2,(H,17,18)