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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=C(C=C(C=C2)Br)F)C

InChI

InChI=1S/C18H18BrFN2O5/c1-4-26-17(24)15-9(2)16(21-10(15)3)18(25)27-8-14(23)22-13-6-5-11(19)7-12(13)20/h5-7,21H,4,8H2,1-3H3,(H,22,23)