(E)-4-[4-[(3-fluorophenyl)methyl]thiophen-2-yl]-2-oxidanyl-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[4-[(3-fluorophenyl)methyl]thiophen-2-yl]-2-oxidanyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[4-[(3-fluorophenyl)methyl]-2-thienyl]-2-hydroxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[4-[(3-fluorophenyl)methyl]-2-thiophenyl]-2-hydroxy-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[4-[(3-fluorophenyl)methyl]thiophen-2-yl]-2-hydroxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[4-(3-fluorobenzyl)-2-thienyl]-2-hydroxy-4-keto-but-2-enoic acid Formula: C15H11FO4S MolecularWeight: 306.308843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CC2=CSC(=C2)C(=O)C=C(C(=O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)CC2=CSC(=C2)C(=O)/C=C(\C(=O)O)/O

InChI

InChI=1S/C15H11FO4S/c16-11-3-1-2-9(5-11)4-10-6-14(21-8-10)12(17)7-13(18)15(19)20/h1-3,5-8,18H,4H2,(H,19,20)/b13-7+