diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-pyrrole-3,4-dicarboxylate

Systemtic Name: diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-pyrrole-3,4-dicarboxylate Openeye Name: diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethyl-pyrrole-3,4-dicarboxylate CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethylpyrrole-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethylpyrrole-3,4-dicarboxylate Traditional Name: 1-homoveratryl-2,5-dimethyl-pyrrole-3,4-dicarboxylic acid diethyl ester Formula: C22H29NO6 MolecularWeight: 403.46876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)CCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)OCC)C)CCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C22H29NO6/c1-7-28-21(24)19-14(3)23(15(4)20(19)22(25)29-8-2)12-11-16-9-10-17(26-5)18(13-16)27-6/h9-10,13H,7-8,11-12H2,1-6H3