6-[(2S)-3-ethanoyl-2-(4-methylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate

Systemtic Name: 6-[(2S)-3-ethanoyl-2-(4-methylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]hexanoate Openeye Name: 6-[(2S)-3-acetyl-4-hydroxy-5-oxo-2-(p-tolyl)-2H-pyrrol-1-yl]hexanoate CAS Name: 6-[(2S)-3-acetyl-4-hydroxy-2-(4-methylphenyl)-5-oxo-2H-pyrrol-1-yl]hexanoate IUPAC Name: 6-[(2S)-3-acetyl-4-hydroxy-2-(4-methylphenyl)-5-oxo-2H-pyrrol-1-yl]hexanoate Traditional Name: 6-[(5S)-4-acetyl-3-hydroxy-2-keto-5-(p-tolyl)-3-pyrrolin-1-yl]hexanoate Formula: C19H22NO5- MolecularWeight: 344.38168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CCCCCC(=O)[O-])O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2C(=C(C(=O)N2CCCCCC(=O)[O-])O)C(=O)C

InChI

InChI=1S/C19H23NO5/c1-12-7-9-14(10-8-12)17-16(13(2)21)18(24)19(25)20(17)11-5-3-4-6-15(22)23/h7-10,17,24H,3-6,11H2,1-2H3,(H,22,23)/p-1/t17-/m0/s1