N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[4-[2-(4-methoxyphenoxy)ethyl]piperazine-1,4-diium-1-yl]acetamide Formula: C21H32N4O3+2 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)CC(=O)NC3(CCCC3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CC[NH+](CC2)CC(=O)NC3(CCCC3)C#N

InChI

InChI=1S/C21H30N4O3/c1-27-18-4-6-19(7-5-18)28-15-14-24-10-12-25(13-11-24)16-20(26)23-21(17-22)8-2-3-9-21/h4-7H,2-3,8-16H2,1H3,(H,23,26)/p+2