ethyl 4-[2-[2-(butylamino)phenyl]carbonyloxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[2-(butylamino)phenyl]carbonyloxyethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[2-(butylamino)benzoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[[2-(butylamino)phenyl]-oxomethoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(butylamino)benzoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[2-(butylamino)benzoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1C(=O)OCC(=O)C2=C(NC(=C2C(=O)OCC)C)C

Isomeric SMILES

CCCCNC1=CC=CC=C1C(=O)OCC(=O)C2=C(NC(=C2C(=O)OCC)C)C

InChI

InChI=1S/C22H28N2O5/c1-5-7-12-23-17-11-9-8-10-16(17)21(26)29-13-18(25)19-14(3)24-15(4)20(19)22(27)28-6-2/h8-11,23-24H,5-7,12-13H2,1-4H3