methyl 4-[[1-(4-fluorophenyl)-4-phenylmethoxy-pyrazol-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(4-fluorophenyl)-4-phenylmethoxy-pyrazol-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[4-benzyloxy-1-(4-fluorophenyl)pyrazole-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-fluorophenyl)-4-phenylmethoxy-3-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-fluorophenyl)-4-phenylmethoxypyrazole-3-carbonyl]amino]benzoate Traditional Name: 4-[[4-benzoxy-1-(4-fluorophenyl)pyrazole-3-carbonyl]amino]benzoic acid methyl ester Formula: C25H20FN3O4 MolecularWeight: 445.442403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=C2OCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=C2OCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H20FN3O4/c1-32-25(31)18-7-11-20(12-8-18)27-24(30)23-22(33-16-17-5-3-2-4-6-17)15-29(28-23)21-13-9-19(26)10-14-21/h2-15H,16H2,1H3,(H,27,30)