3-[3-ethanoyl-2-(4-methylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propanoic acid

Systemtic Name: 3-[3-ethanoyl-2-(4-methylphenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]propanoic acid Openeye Name: 3-[3-acetyl-4-hydroxy-5-oxo-2-(p-tolyl)-2H-pyrrol-1-yl]propanoic acid CAS Name: 3-[3-acetyl-4-hydroxy-2-(4-methylphenyl)-5-oxo-2H-pyrrol-1-yl]propanoic acid IUPAC Name: 3-[3-acetyl-4-hydroxy-2-(4-methylphenyl)-5-oxo-2H-pyrrol-1-yl]propanoic acid Traditional Name: 3-[4-acetyl-3-hydroxy-2-keto-5-(p-tolyl)-3-pyrrolin-1-yl]propionic acid Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CCC(=O)O)O)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CCC(=O)O)O)C(=O)C

InChI

InChI=1S/C16H17NO5/c1-9-3-5-11(6-4-9)14-13(10(2)18)15(21)16(22)17(14)8-7-12(19)20/h3-6,14,21H,7-8H2,1-2H3,(H,19,20)