O2-[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-[1-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethyl] O4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-[1-(4-bromophenyl)ethylamino]-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-[1-(4-bromophenyl)ethylamino]-2-oxoethyl] ester O4-ethyl ester IUPAC Name: 2-O-[2-[1-(4-bromophenyl)ethylamino]-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-[1-(4-bromophenyl)ethylamino]-2-keto-ethyl] ester O4-ethyl ester Formula: C20H23BrN2O5 MolecularWeight: 451.31102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O5/c1-5-27-19(25)17-11(2)18(23-13(17)4)20(26)28-10-16(24)22-12(3)14-6-8-15(21)9-7-14/h6-9,12,23H,5,10H2,1-4H3,(H,22,24)