1-(4-fluorophenyl)-3-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-3-(4-methylphenyl)-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-N-(2-morpholin-4-ium-4-ylethyl)-3-(p-tolyl)pyrazole-4-carboxamide Formula: C23H26FN4O2+ MolecularWeight: 409.476543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC[NH+]3CCOCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NCC[NH+]3CCOCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN4O2/c1-17-2-4-18(5-3-17)22-21(16-28(26-22)20-8-6-19(24)7-9-20)23(29)25-10-11-27-12-14-30-15-13-27/h2-9,16H,10-15H2,1H3,(H,25,29)/p+1