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

Systemtic Name: ethyl 2,5-dimethyl-4-[2-(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-[4-oxo-4-(2-thienyl)butanoyl]oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 4-[2-(1,4-dioxo-4-thiophen-2-ylbutoxy)-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-(4-oxo-4-thiophen-2-ylbutanoyl)oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[4-keto-4-(2-thienyl)butanoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=CS2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=CS2)C)C

InChI

InChI=1S/C19H21NO6S/c1-4-25-19(24)18-12(3)20-11(2)17(18)14(22)10-26-16(23)8-7-13(21)15-6-5-9-27-15/h5-6,9,20H,4,7-8,10H2,1-3H3