ethyl 2,4-dimethyl-5-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-[4-(3-oxidanylidenebutyl)phenoxy]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-[4-(3-oxobutyl)phenoxy]acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[4-(3-oxobutyl)phenoxy]ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-[4-(3-oxobutyl)phenoxy]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(3-ketobutyl)phenoxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC2=CC=C(C=C2)CCC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC2=CC=C(C=C2)CCC(=O)C)C

InChI

InChI=1S/C21H25NO5/c1-5-26-21(25)19-14(3)20(22-15(19)4)18(24)12-27-17-10-8-16(9-11-17)7-6-13(2)23/h8-11,22H,5-7,12H2,1-4H3