N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-3-pyrazol-1-yl-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-3-pyrazol-1-yl-N-(pyridin-3-ylmethyl)propanamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-3-pyrazol-1-yl-N-(3-pyridylmethyl)propanamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-3-(1-pyrazolyl)-N-(3-pyridinylmethyl)propanamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-3-pyrazol-1-yl-N-(pyridin-3-ylmethyl)propanamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-3-pyrazol-1-yl-N-(3-pyridylmethyl)propionamide Formula: C24H36N5O+ MolecularWeight: 410.57554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)CN(CC3=CN=CC=C3)C(=O)CCN4C=CC=N4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)CN(CC3=CN=CC=C3)C(=O)CCN4C=CC=N4

InChI

InChI=1S/C24H35N5O/c30-24(11-16-29-15-6-13-26-29)28(18-21-7-4-12-25-17-21)20-22-8-5-14-27(19-22)23-9-2-1-3-10-23/h4,6-7,12-13,15,17,22-23H,1-3,5,8-11,14,16,18-20H2/p+1/t22-/m0/s1