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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)C2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)OCC(=O)C2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C22H27NO5/c1-7-27-21(26)19-13(2)18(14(3)23-19)20(25)28-12-17(24)15-8-10-16(11-9-15)22(4,5)6/h8-11,23H,7,12H2,1-6H3