2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide CAS Name: 2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 2-(4-chlorophenyl)-5-(2-fluorophenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Formula: C22H23ClFN4O+ MolecularWeight: 413.895623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

InChI

InChI=1S/C22H22ClFN4O/c23-16-7-9-17(10-8-16)28-21(22(29)25-11-14-27-12-3-4-13-27)15-20(26-28)18-5-1-2-6-19(18)24/h1-2,5-10,15H,3-4,11-14H2,(H,25,29)/p+1