diethyl 3-methyl-5-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxymethyl]-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxymethyl]-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[4-oxo-4-(2-thienyl)butanoyl]oxymethyl]-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-[(1,4-dioxo-4-thiophen-2-ylbutoxy)methyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[(4-oxo-4-thiophen-2-ylbutanoyl)oxymethyl]-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-[[4-keto-4-(2-thienyl)butanoyl]oxymethyl]-3-methyl-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C20H23NO7S MolecularWeight: 421.46412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO7S/c1-4-26-19(24)17-12(3)18(20(25)27-5-2)21-13(17)11-28-16(23)9-8-14(22)15-7-6-10-29-15/h6-7,10,21H,4-5,8-9,11H2,1-3H3