O4-ethyl O2-(4-oxidanylidene-4-thiophen-2-yl-butyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-(4-oxidanylidene-4-thiophen-2-yl-butyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[4-oxo-4-(2-thienyl)butyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-(4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: 4-O-ethyl 2-O-(4-oxo-4-thiophen-2-ylbutyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[4-keto-4-(2-thienyl)butyl] ester Formula: C18H21NO5S MolecularWeight: 363.42804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5S/c1-4-23-17(21)15-11(2)16(19-12(15)3)18(22)24-9-5-7-13(20)14-8-6-10-25-14/h6,8,10,19H,4-5,7,9H2,1-3H3