2-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: 2-(4-fluorophenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-5-phenyl-3-pyrazolecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-5-phenylpyrazole-3-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-5-phenyl-pyrazole-3-carboxamide Formula: C22H24FN4O2+ MolecularWeight: 395.449963

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN4O2/c23-18-6-8-19(9-7-18)27-21(16-20(25-27)17-4-2-1-3-5-17)22(28)24-10-11-26-12-14-29-15-13-26/h1-9,16H,10-15H2,(H,24,28)/p+1