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

Systemtic Name: O4-[2-(2,5-diethylphenyl)-2-oxidanylidene-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-[2-(2,5-diethylphenyl)-2-oxo-ethyl] O2-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-(2,5-diethylphenyl)-2-oxoethyl] ester O2-ethyl ester IUPAC Name: 4-O-[2-(2,5-diethylphenyl)-2-oxoethyl] 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-[2-(2,5-diethylphenyl)-2-keto-ethyl] ester O2-ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)COC(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C22H27NO5/c1-6-15-9-10-16(7-2)17(11-15)18(24)12-28-21(25)19-13(4)20(23-14(19)5)22(26)27-8-3/h9-11,23H,6-8,12H2,1-5H3