[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate

Systemtic Name: [2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate Openeye Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 2-(4-fluorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-fluorophenoxy)-2-methylpropanoic acid [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 2-(4-fluorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-fluorophenoxy)-2-methyl-propionic acid [2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl] ester Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC(=O)N1CCC(=N1)C2=CC=CC=C2)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C(=O)OCC(=O)N1CCC(=N1)C2=CC=CC=C2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN2O4/c1-21(2,28-17-10-8-16(22)9-11-17)20(26)27-14-19(25)24-13-12-18(23-24)15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3