N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-N-(2-piperidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-N-(2-piperidin-1-ium-1-ylethyl)ethanamide Openeye Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-N-(2-piperidin-1-ium-1-ylethyl)acetamide CAS Name: N-[[(3R)-1-cyclopentyl-3-piperidin-1-iumyl]methyl]-2-(3,5-dimethyl-1-pyrazolyl)-N-[2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-N-(2-piperidin-1-ium-1-ylethyl)acetamide Traditional Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-(3,5-dimethylpyrazol-1-yl)-N-(2-piperidin-1-ium-1-ylethyl)acetamide Formula: C25H45N5O+2 MolecularWeight: 431.6577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)N(CC[NH+]2CCCCC2)CC3CCC[NH+](C3)C4CCCC4)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)N(CC[NH+]2CCCCC2)C[C@H]3CCC[NH+](C3)C4CCCC4)C

InChI

InChI=1S/C25H43N5O/c1-21-17-22(2)30(26-21)20-25(31)29(16-15-27-12-6-3-7-13-27)19-23-9-8-14-28(18-23)24-10-4-5-11-24/h17,23-24H,3-16,18-20H2,1-2H3/p+2/t23-/m0/s1