2-dodecylsulfanyl-3,5,6-trimethoxy-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-dodecylsulfanyl-3,5,6-trimethoxy-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-dodecylsulfanyl-3,5,6-trimethoxy-1,4-benzoquinone CAS Name: 2-(dodecylthio)-3,5,6-trimethoxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-dodecylsulfanyl-3,5,6-trimethoxycyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(laurylthio)-3,5,6-trimethoxy-p-benzoquinone Formula: C21H34O5S MolecularWeight: 398.55666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=C(C(=O)C(=C(C1=O)OC)OC)OC

Isomeric SMILES

CCCCCCCCCCCCSC1=C(C(=O)C(=C(C1=O)OC)OC)OC

InChI

InChI=1S/C21H34O5S/c1-5-6-7-8-9-10-11-12-13-14-15-27-21-17(23)19(25-3)18(24-2)16(22)20(21)26-4/h5-15H2,1-4H3