O2-[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] O4-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] ester O4-methyl ester IUPAC Name: 2-O-[1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] 4-O-methyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester O4-methyl ester Formula: C18H18BrFN2O5 MolecularWeight: 441.248323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)OC(C)C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)OC(C)C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C18H18BrFN2O5/c1-8-14(17(24)26-4)9(2)21-15(8)18(25)27-10(3)16(23)22-13-6-5-11(19)7-12(13)20/h5-7,10,21H,1-4H3,(H,22,23)