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

Systemtic Name: ethyl 5-[2-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[4-(2,5-dimethyl-3-thiophenyl)-1,4-dioxobutoxy]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(2,5-dimethyl-3-thienyl)-4-keto-butanoyl]oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)CCC(=O)C2=C(SC(=C2)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)CCC(=O)C2=C(SC(=C2)C)C)C

InChI

InChI=1S/C22H27NO6S/c1-7-28-22(27)19-12(3)20(23-13(19)4)21(26)14(5)29-18(25)9-8-17(24)16-10-11(2)30-15(16)6/h10,14,23H,7-9H2,1-6H3