ethyl 1-[3-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[3-[[2-(3-fluoro-4-methoxyphenyl)-1-oxoethyl]amino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[3-[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C22H22FN3O4 MolecularWeight: 411.426183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C22H22FN3O4/c1-4-30-22(28)18-13-24-26(14(18)2)17-7-5-6-16(12-17)25-21(27)11-15-8-9-20(29-3)19(23)10-15/h5-10,12-13H,4,11H2,1-3H3,(H,25,27)