N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[4-(2,5-dimethoxybenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C23H35N5O3+2 MolecularWeight: 429.5557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C23H33N5O3/c1-30-20-7-8-21(31-2)18(15-20)16-26-11-13-27(14-12-26)17-23(29)25-22-9-10-24-28(22)19-5-3-4-6-19/h7-10,15,19H,3-6,11-14,16-17H2,1-2H3,(H,25,29)/p+2