dimethyl 5-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H18F3N3O5 MolecularWeight: 413.34783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O5/c1-10-6-14(18(19,20)21)23-24(10)5-4-15(25)22-13-8-11(16(26)28-2)7-12(9-13)17(27)29-3/h6-9H,4-5H2,1-3H3,(H,22,25)