2-(cyclohexen-1-yl)-5,6-dimethoxy-3-phenylsulfanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(cyclohexen-1-yl)-5,6-dimethoxy-3-phenylsulfanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(cyclohexen-1-yl)-5,6-dimethoxy-3-phenylsulfanyl-1,4-benzoquinone CAS Name: 2-(1-cyclohexenyl)-5,6-dimethoxy-3-(phenylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(cyclohexen-1-yl)-5,6-dimethoxy-3-phenylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(cyclohexen-1-yl)-5,6-dimethoxy-3-(phenylthio)-p-benzoquinone Formula: C20H20O4S MolecularWeight: 356.4354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)C(=C(C1=O)C2=CCCCC2)SC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C(=O)C(=C(C1=O)C2=CCCCC2)SC3=CC=CC=C3)OC

InChI

InChI=1S/C20H20O4S/c1-23-18-16(21)15(13-9-5-3-6-10-13)20(17(22)19(18)24-2)25-14-11-7-4-8-12-14/h4,7-9,11-12H,3,5-6,10H2,1-2H3