N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]-2-ethyl-5-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]-2-ethyl-5-methyl-pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]-2-ethyl-5-methyl-pyrazole-3-carboxamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-4-piperidin-1-iumyl]-2-ethyl-5-methyl-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]piperidin-1-ium-4-yl]-2-ethyl-5-methylpyrazole-3-carboxamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)piperidin-1-ium-4-yl]-2-ethyl-5-methyl-pyrazole-3-carboxamide Formula: C19H25ClFN4O+ MolecularWeight: 379.879403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)NC2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)NC2CC[NH+](CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H24ClFN4O/c1-3-25-18(11-13(2)23-25)19(26)22-14-7-9-24(10-8-14)12-15-16(20)5-4-6-17(15)21/h4-6,11,14H,3,7-10,12H2,1-2H3,(H,22,26)/p+1