(E)-4-oxidanyl-2-oxidanylidene-4-(5-phenylsulfanylthiophen-3-yl)but-3-enoic acid

Systemtic Name: (E)-4-oxidanyl-2-oxidanylidene-4-(5-phenylsulfanylthiophen-3-yl)but-3-enoic acid Openeye Name: (E)-4-hydroxy-2-oxo-4-(5-phenylsulfanyl-3-thienyl)but-3-enoic acid CAS Name: (E)-4-hydroxy-2-oxo-4-[5-(phenylthio)-3-thiophenyl]-3-butenoic acid IUPAC Name: (E)-4-hydroxy-2-oxo-4-(5-phenylsulfanylthiophen-3-yl)but-3-enoic acid Traditional Name: (E)-4-hydroxy-2-keto-4-[5-(phenylthio)-3-thienyl]but-3-enoic acid Formula: C14H10O4S2 MolecularWeight: 306.3568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC(=CS2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC(=CS2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C14H10O4S2/c15-11(7-12(16)14(17)18)9-6-13(19-8-9)20-10-4-2-1-3-5-10/h1-8,15H,(H,17,18)/b11-7+