2,3-dimethoxy-5-(phenylmethylsulfanyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethoxy-5-(phenylmethylsulfanyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-benzylsulfanyl-2,3-dimethoxy-1,4-benzoquinone CAS Name: 2,3-dimethoxy-5-(phenylmethylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-benzylsulfanyl-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione Traditional Name: 5-(benzylthio)-2,3-dimethoxy-p-benzoquinone Formula: C15H14O4S MolecularWeight: 290.33426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C(=CC1=O)SCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C(=O)C(=CC1=O)SCC2=CC=CC=C2)OC

InChI

InChI=1S/C15H14O4S/c1-18-14-11(16)8-12(13(17)15(14)19-2)20-9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3