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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)C)C(=O)OCC

Isomeric SMILES

CCC1=C(NC(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)C)C(=O)OCC

InChI

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