ethyl 4-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C15H25N4O3+ MolecularWeight: 309.384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C15H24N4O3/c1-2-22-14(21)19-9-7-18(8-10-19)11-13(20)17-15(12-16)5-3-4-6-15/h2-11H2,1H3,(H,17,20)/p+1