N-(1-cyanocyclopentyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(1-cyanocyclopentyl)-2-(4-p-anisylpiperazine-1,4-diium-1-yl)acetamide Formula: C20H30N4O2+2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N4O2/c1-26-18-6-4-17(5-7-18)14-23-10-12-24(13-11-23)15-19(25)22-20(16-21)8-2-3-9-20/h4-7H,2-3,8-15H2,1H3,(H,22,25)/p+2