1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropanecarboxamide CAS Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)-3-piperidin-1-iumyl]methyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropane-1-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-1-ium-3-yl]methyl]cyclopropanecarboxamide Formula: C20H26ClN4O+ MolecularWeight: 373.89964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=NN2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=NN2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H25ClN4O/c21-17-5-3-16(4-6-17)20(8-9-20)19(26)22-12-15-2-1-11-25(13-15)14-18-7-10-23-24-18/h3-7,10,15H,1-2,8-9,11-14H2,(H,22,26)(H,23,24)/p+1/t15-/m1/s1