N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine CAS Name: N-[[(3R)-1-cyclopentyl-3-piperidin-1-iumyl]methyl]-N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-2-piperidin-1-ium-1-ylethanamine Traditional Name: [(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-(2-piperidin-1-ium-1-ylethyl)amine Formula: C26H49N5+2 MolecularWeight: 431.70076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H47N5/c1-4-31-23(3)26(22(2)27-31)21-29(18-17-28-14-8-5-9-15-28)19-24-11-10-16-30(20-24)25-12-6-7-13-25/h24-25H,4-21H2,1-3H3/p+2/t24-/m1/s1