(1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-[(2-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-(2-fluoroanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-[2-(2-fluoroanilino)-2-oxoethyl]-methylammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-(2-fluoroanilino)-2-oxoethyl]-methylazanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[2-(2-fluoroanilino)-2-keto-ethyl]-methyl-ammonium Formula: C25H24FN4O+ MolecularWeight: 415.482663

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4F

Isomeric SMILES

C[NH+](CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C25H23FN4O/c1-29(18-24(31)27-23-15-9-8-14-22(23)26)16-20-17-30(21-12-6-3-7-13-21)28-25(20)19-10-4-2-5-11-19/h2-15,17H,16,18H2,1H3,(H,27,31)/p+1