dimethyl 3-[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbonylamino]pyrazol-1-yl]pentanedioate

Systemtic Name: dimethyl 3-[4-[[4-methoxy-3-(trifluoromethyl)phenyl]carbonylamino]pyrazol-1-yl]pentanedioate Openeye Name: dimethyl 3-[4-[[4-methoxy-3-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]pentanedioate CAS Name: 3-[4-[[[4-methoxy-3-(trifluoromethyl)phenyl]-oxomethyl]amino]-1-pyrazolyl]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-[4-[[4-methoxy-3-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]pentanedioate Traditional Name: 3-[4-[[4-methoxy-3-(trifluoromethyl)benzoyl]amino]pyrazol-1-yl]glutaric acid dimethyl ester Formula: C19H20F3N3O6 MolecularWeight: 443.37381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CN(N=C2)C(CC(=O)OC)CC(=O)OC)C(F)(F)F

InChI

InChI=1S/C19H20F3N3O6/c1-29-15-5-4-11(6-14(15)19(20,21)22)18(28)24-12-9-23-25(10-12)13(7-16(26)30-2)8-17(27)31-3/h4-6,9-10,13H,7-8H2,1-3H3,(H,24,28)