(3,3-dimethyl-2-oxidanylidene-butyl) 3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-2-propenoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]acrylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C19H20ClFN2O3 MolecularWeight: 378.825103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC(=O)C(C)(C)C)Cl)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)OCC(=O)C(C)(C)C)Cl)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H20ClFN2O3/c1-12-15(9-10-17(25)26-11-16(24)19(2,3)4)18(20)23(22-12)14-7-5-13(21)6-8-14/h5-10H,11H2,1-4H3