N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Openeye Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide CAS Name: N-[[(3R)-1-cyclopentyl-3-piperidin-1-iumyl]methyl]-2-ethyl-5-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Traditional Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Formula: C25H45N5O+2 MolecularWeight: 431.6577

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)N(CC[NH+]2CCCCC2)CC3CCC[NH+](C3)C4CCCC4

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)N(CC[NH+]2CCCCC2)C[C@H]3CCC[NH+](C3)C4CCCC4

InChI

InChI=1S/C25H43N5O/c1-3-30-24(18-21(2)26-30)25(31)29(17-16-27-13-7-4-8-14-27)20-22-10-9-15-28(19-22)23-11-5-6-12-23/h18,22-23H,3-17,19-20H2,1-2H3/p+2/t22-/m0/s1