butyl-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: butyl-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: butyl-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]ammonium CAS Name: butyl-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]ammonium IUPAC Name: butyl-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]azanium Traditional Name: butyl-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]ammonium Formula: C21H24FN4O+ MolecularWeight: 367.439863

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCCC[NH2+]CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H23FN4O/c1-2-3-13-23-15-21(27)24-20-14-19(16-7-5-4-6-8-16)25-26(20)18-11-9-17(22)10-12-18/h4-12,14,23H,2-3,13,15H2,1H3,(H,24,27)/p+1