N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-(4-fluorophenyl)-5-methyl-3-pyrazolyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-(4-fluorophenyl)-5-methyl-pyrazol-3-yl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C22H25FN5O2+ MolecularWeight: 410.464603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN5O2/c1-16-14-21(28(25-16)19-4-2-17(23)3-5-19)24-22(30)15-26-10-12-27(13-11-26)18-6-8-20(29)9-7-18/h2-9,14,29H,10-13,15H2,1H3,(H,24,30)/p+1