ethyl 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3,4-dimethoxyphenyl)ethylamino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(homoveratrylamino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)CNCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)CNCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C20H28N2O4/c1-6-26-20(23)19-13(2)16(14(3)22-19)12-21-10-9-15-7-8-17(24-4)18(11-15)25-5/h7-8,11,21-22H,6,9-10,12H2,1-5H3