4-[(4-fluorophenyl)methyl]-5-[(1-methyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-3-yl)carbonyl]furan-2-carboxylic acid

Systemtic Name: 4-[(4-fluorophenyl)methyl]-5-[(1-methyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-3-yl)carbonyl]furan-2-carboxylic acid Openeye Name: 4-[(4-fluorophenyl)methyl]-5-(4-hydroxy-1-methyl-5-oxo-2H-pyrrole-3-carbonyl)furan-2-carboxylic acid CAS Name: 4-[(4-fluorophenyl)methyl]-5-[(4-hydroxy-1-methyl-5-oxo-2H-pyrrol-3-yl)-oxomethyl]-2-furancarboxylic acid IUPAC Name: 4-[(4-fluorophenyl)methyl]-5-(4-hydroxy-1-methyl-5-oxo-2H-pyrrole-3-carbonyl)furan-2-carboxylic acid Traditional Name: 4-(4-fluorobenzyl)-5-(4-hydroxy-5-keto-1-methyl-3-pyrroline-3-carbonyl)-2-furoic acid Formula: C18H14FNO6 MolecularWeight: 359.305263

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=C(C1=O)O)C(=O)C2=C(C=C(O2)C(=O)O)CC3=CC=C(C=C3)F

Isomeric SMILES

CN1CC(=C(C1=O)O)C(=O)C2=C(C=C(O2)C(=O)O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FNO6/c1-20-8-12(15(22)17(20)23)14(21)16-10(7-13(26-16)18(24)25)6-9-2-4-11(19)5-3-9/h2-5,7,22H,6,8H2,1H3,(H,24,25)