ethyl 2,5-dimethyl-4-[2-(4-oxidanylidene-4-phenyl-butanoyl)oxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(4-oxidanylidene-4-phenyl-butanoyl)oxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-(4-oxo-4-phenyl-butanoyl)oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 4-[2-(1,4-dioxo-4-phenylbutoxy)-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(4-oxo-4-phenylbutanoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(4-keto-4-phenyl-butanoyl)oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO6/c1-4-27-21(26)20-14(3)22-13(2)19(20)17(24)12-28-18(25)11-10-16(23)15-8-6-5-7-9-15/h5-9,22H,4,10-12H2,1-3H3