(2S)-2-(4-ethylphenyl)-1-[2-(2-hydroxyethyloxy)ethyl]-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-2-(4-ethylphenyl)-1-[2-(2-hydroxyethyloxy)ethyl]-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-2-(4-ethylphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-2-(4-ethylphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-2-(4-ethylphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-5-(4-ethylphenyl)-1-[2-(2-hydroxyethoxy)ethyl]-2-keto-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C21H22NO5S- MolecularWeight: 400.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(C(=O)N2CCOCCO)[O-])C(=O)C3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2CCOCCO)[O-])C(=O)C3=CC=CS3

InChI

InChI=1S/C21H23NO5S/c1-2-14-5-7-15(8-6-14)18-17(19(24)16-4-3-13-28-16)20(25)21(26)22(18)9-11-27-12-10-23/h3-8,13,18,23,25H,2,9-12H2,1H3/p-1/t18-/m0/s1