2-[4-[(2S)-3-ethanoyl-2-(4-ethylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(2S)-3-ethanoyl-2-(4-ethylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]phenoxy]ethanoate Openeye Name: 2-[4-[(2S)-3-acetyl-2-(4-ethylphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]phenoxy]acetate CAS Name: 2-[4-[(2S)-3-acetyl-2-(4-ethylphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]phenoxy]acetate IUPAC Name: 2-[4-[(2S)-3-acetyl-2-(4-ethylphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]phenoxy]acetate Traditional Name: 2-[4-[(2S)-3-acetyl-2-(4-ethylphenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]phenoxy]acetate Formula: C22H20NO6- MolecularWeight: 394.3973

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=CC=C(C=C3)OCC(=O)[O-])O)C(=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2C3=CC=C(C=C3)OCC(=O)[O-])O)C(=O)C

InChI

InChI=1S/C22H21NO6/c1-3-14-4-6-15(7-5-14)20-19(13(2)24)21(27)22(28)23(20)16-8-10-17(11-9-16)29-12-18(25)26/h4-11,20,27H,3,12H2,1-2H3,(H,25,26)/p-1/t20-/m0/s1