4-(phenylmethylsulfanyl)-2H-pyran-5,6-dione

Systemtic Name: 4-(phenylmethylsulfanyl)-2H-pyran-5,6-dione Openeye Name: 4-benzylsulfanyl-2H-pyran-5,6-dione CAS Name: 4-(phenylmethylthio)-2H-pyran-5,6-dione IUPAC Name: 4-benzylsulfanyl-2H-pyran-5,6-dione Traditional Name: 4-(benzylthio)-2H-pyran-5,6-quinone Formula: C12H10O3S MolecularWeight: 234.271

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C(=O)C(=O)O1)SCC2=CC=CC=C2

Isomeric SMILES

C1C=C(C(=O)C(=O)O1)SCC2=CC=CC=C2

InChI

InChI=1S/C12H10O3S/c13-11-10(6-7-15-12(11)14)16-8-9-4-2-1-3-5-9/h1-6H,7-8H2