(2R)-2-(3-ethoxy-4-oxidanyl-phenyl)-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-2-(3-ethoxy-4-oxidanyl-phenyl)-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-2-(3-ethoxy-4-hydroxy-phenyl)-1-(3-morpholinopropyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-2-(3-ethoxy-4-hydroxyphenyl)-1-[3-(4-morpholinyl)propyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2R)-2-(3-ethoxy-4-hydroxyphenyl)-1-(3-morpholin-4-ylpropyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-5-(3-ethoxy-4-hydroxy-phenyl)-2-keto-1-(3-morpholinopropyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C24H27N2O6S- MolecularWeight: 471.54598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C(=O)N2CCCN3CCOCC3)[O-])C(=O)C4=CC=CS4)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@@H]2C(=C(C(=O)N2CCCN3CCOCC3)[O-])C(=O)C4=CC=CS4)O

InChI

InChI=1S/C24H28N2O6S/c1-2-32-18-15-16(6-7-17(18)27)21-20(22(28)19-5-3-14-33-19)23(29)24(30)26(21)9-4-8-25-10-12-31-13-11-25/h3,5-7,14-15,21,27,29H,2,4,8-13H2,1H3/p-1/t21-/m1/s1