2-chloranyl-5,6-dimethoxy-3-octylsulfanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-chloranyl-5,6-dimethoxy-3-octylsulfanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-chloro-5,6-dimethoxy-3-octylsulfanyl-1,4-benzoquinone CAS Name: 2-chloro-5,6-dimethoxy-3-(octylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-chloro-5,6-dimethoxy-3-octylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-chloro-5,6-dimethoxy-3-(octylthio)-p-benzoquinone Formula: C16H23ClO4S MolecularWeight: 346.86942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=C(C(=O)C(=C(C1=O)OC)OC)Cl

Isomeric SMILES

CCCCCCCCSC1=C(C(=O)C(=C(C1=O)OC)OC)Cl

InChI

InChI=1S/C16H23ClO4S/c1-4-5-6-7-8-9-10-22-16-11(17)12(18)14(20-2)15(21-3)13(16)19/h4-10H2,1-3H3