(2R)-2-(3,4-diethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-2-(3,4-diethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-2-(3,4-diethoxyphenyl)-1-(3-morpholinopropyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-2-(3,4-diethoxyphenyl)-1-[3-(4-morpholinyl)propyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2R)-2-(3,4-diethoxyphenyl)-1-(3-morpholin-4-ylpropyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-5-(3,4-diethoxyphenyl)-2-keto-1-(3-morpholinopropyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C26H31N2O6S- MolecularWeight: 499.59914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O6S/c1-3-33-19-9-8-18(17-20(19)34-4-2)23-22(24(29)21-7-5-16-35-21)25(30)26(31)28(23)11-6-10-27-12-14-32-15-13-27/h5,7-9,16-17,23,30H,3-4,6,10-15H2,1-2H3/p-1/t23-/m1/s1