(2S)-1-(2-methoxyethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-(2-methoxyethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-hydroxy-3-methoxy-phenyl)-1-(2-methoxyethyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-hydroxy-3-methoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-hydroxy-3-methoxyphenyl)-1-(2-methoxyethyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-5-(4-hydroxy-3-methoxy-phenyl)-2-keto-1-(2-methoxyethyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C19H18NO6S- MolecularWeight: 388.41432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC(=C(C=C3)O)OC

Isomeric SMILES

COCCN1[C@H](C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC(=C(C=C3)O)OC

InChI

InChI=1S/C19H19NO6S/c1-25-8-7-20-16(11-5-6-12(21)13(10-11)26-2)15(18(23)19(20)24)17(22)14-4-3-9-27-14/h3-6,9-10,16,21,23H,7-8H2,1-2H3/p-1/t16-/m0/s1