[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl] 1-(o-tolyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-fluoroanilino)-2-oxoethyl] 1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(o-tolyl)pyrrolidine-3-carboxylic acid [2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl] ester Formula: C20H18BrFN2O4 MolecularWeight: 449.270323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC=CC=C1N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H18BrFN2O4/c1-12-4-2-3-5-17(12)24-10-13(8-19(24)26)20(27)28-11-18(25)23-16-7-6-14(21)9-15(16)22/h2-7,9,13H,8,10-11H2,1H3,(H,23,25)