(3-fluoranyl-4-methoxy-phenyl)methyl 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)OCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)OCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C23H25FN2O4/c1-15-20(16(2)26(25-15)18-6-5-7-19(13-18)28-3)9-11-23(27)30-14-17-8-10-22(29-4)21(24)12-17/h5-8,10,12-13H,9,11,14H2,1-4H3