N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)-1H-pyrazole-3-carboxamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-5-methyl-N-(3-pyridinylmethyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(3-pyridylmethyl)-1H-pyrazole-3-carboxamide Formula: C23H34N5O+ MolecularWeight: 396.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)N(CC2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=NN1)C(=O)N(C[C@H]2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C23H33N5O/c1-18-13-22(26-25-18)23(29)28(15-19-7-5-11-24-14-19)17-20-8-6-12-27(16-20)21-9-3-2-4-10-21/h5,7,11,13-14,20-21H,2-4,6,8-10,12,15-17H2,1H3,(H,25,26)/p+1/t20-/m0/s1