(2-ethoxy-2-oxidanylidene-ethyl)-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-azanium

Systemtic Name: (2-ethoxy-2-oxidanylidene-ethyl)-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-azanium Openeye Name: (2-ethoxy-2-oxo-ethyl)-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium CAS Name: (2-ethoxy-2-oxoethyl)-[[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-methylammonium IUPAC Name: (2-ethoxy-2-oxoethyl)-[[3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-methylazanium Traditional Name: (2-ethoxy-2-keto-ethyl)-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-methyl-ammonium Formula: C22H25FN3O3+ MolecularWeight: 398.450603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+](C)CC1=CN(N=C1C2=C(C=C(C=C2)OC)F)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[NH+](C)CC1=CN(N=C1C2=C(C=C(C=C2)OC)F)C3=CC=CC=C3

InChI

InChI=1S/C22H24FN3O3/c1-4-29-21(27)15-25(2)13-16-14-26(17-8-6-5-7-9-17)24-22(16)19-11-10-18(28-3)12-20(19)23/h5-12,14H,4,13,15H2,1-3H3/p+1