(2R)-1-[2-(diethylazaniumyl)ethyl]-2-(4-ethoxy-3-methoxy-phenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-1-[2-(diethylazaniumyl)ethyl]-2-(4-ethoxy-3-methoxy-phenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-1-[2-(diethylammonio)ethyl]-2-(4-ethoxy-3-methoxy-phenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-1-[2-(diethylammonio)ethyl]-2-(4-ethoxy-3-methoxyphenyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2R)-1-[2-(diethylazaniumyl)ethyl]-2-(4-ethoxy-3-methoxyphenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-1-[2-(diethylammonio)ethyl]-5-(4-ethoxy-3-methoxy-phenyl)-2-keto-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC(=C(C=C3)OCC)OC

Isomeric SMILES

CC[NH+](CC)CCN1[C@@H](C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC(=C(C=C3)OCC)OC

InChI

InChI=1S/C24H30N2O5S/c1-5-25(6-2)12-13-26-21(16-10-11-17(31-7-3)18(15-16)30-4)20(23(28)24(26)29)22(27)19-9-8-14-32-19/h8-11,14-15,21,28H,5-7,12-13H2,1-4H3/t21-/m1/s1