ethyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-(homoveratrylcarbamoyl)-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCCC2=CC(=C(C=C2)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCCC2=CC(=C(C=C2)OC)OC)C

InChI

InChI=1S/C21H28N2O5/c1-7-28-21(25)19-13(2)18(14(3)23(19)4)20(24)22-11-10-15-8-9-16(26-5)17(12-15)27-6/h8-9,12H,7,10-11H2,1-6H3,(H,22,24)