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

Systemtic Name: 4-[3-ethanoyl-2-(4-iodophenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]butanoic acid Openeye Name: 4-[3-acetyl-4-hydroxy-2-(4-iodophenyl)-5-oxo-2H-pyrrol-1-yl]butanoic acid CAS Name: 4-[3-acetyl-4-hydroxy-2-(4-iodophenyl)-5-oxo-2H-pyrrol-1-yl]butanoic acid IUPAC Name: 4-[3-acetyl-4-hydroxy-2-(4-iodophenyl)-5-oxo-2H-pyrrol-1-yl]butanoic acid Traditional Name: 4-[3-acetyl-4-hydroxy-2-(4-iodophenyl)-5-keto-3-pyrrolin-1-yl]butyric acid Formula: C16H16INO5 MolecularWeight: 429.20641

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)I)CCCC(=O)O)O

Isomeric SMILES

CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)I)CCCC(=O)O)O

InChI

InChI=1S/C16H16INO5/c1-9(19)13-14(10-4-6-11(17)7-5-10)18(16(23)15(13)22)8-2-3-12(20)21/h4-7,14,22H,2-3,8H2,1H3,(H,20,21)