dimethyl 2-[[1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-(3-chloranyl-4-fluoranyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-(3-chloro-4-fluoro-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-(3-chloro-4-fluorophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-(3-chloro-4-fluorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(3-chloro-4-fluoro-phenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H18ClFN2O6 MolecularWeight: 448.828823

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H18ClFN2O6/c1-30-20(28)11-3-5-14(21(29)31-2)17(7-11)24-19(27)12-8-18(26)25(10-12)13-4-6-16(23)15(22)9-13/h3-7,9,12H,8,10H2,1-2H3,(H,24,27)