diethyl 2-[2-[2-(3-ethylthiophen-2-yl)carbonylpyrrol-1-yl]ethyl]propanedioate

Systemtic Name: diethyl 2-[2-[2-(3-ethylthiophen-2-yl)carbonylpyrrol-1-yl]ethyl]propanedioate Openeye Name: diethyl 2-[2-[2-(3-ethylthiophene-2-carbonyl)pyrrol-1-yl]ethyl]propanedioate CAS Name: 2-[2-[2-[(3-ethyl-2-thiophenyl)-oxomethyl]-1-pyrrolyl]ethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[2-(3-ethylthiophene-2-carbonyl)pyrrol-1-yl]ethyl]propanedioate Traditional Name: 2-[2-[2-(3-ethylthiophene-2-carbonyl)pyrrol-1-yl]ethyl]malonic acid diethyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1)C(=O)C2=CC=CN2CCC(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC1=C(SC=C1)C(=O)C2=CC=CN2CCC(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H25NO5S/c1-4-14-10-13-27-18(14)17(22)16-8-7-11-21(16)12-9-15(19(23)25-5-2)20(24)26-6-3/h7-8,10-11,13,15H,4-6,9,12H2,1-3H3