6-ethyl-4-methyl-5-phenylsulfanyl-cyclohex-4-ene-1,3-dione

Systemtic Name: 6-ethyl-4-methyl-5-phenylsulfanyl-cyclohex-4-ene-1,3-dione Openeye Name: 6-ethyl-4-methyl-5-phenylsulfanyl-cyclohex-4-ene-1,3-dione CAS Name: 6-ethyl-4-methyl-5-(phenylthio)cyclohex-4-ene-1,3-dione IUPAC Name: 6-ethyl-4-methyl-5-phenylsulfanylcyclohex-4-ene-1,3-dione Traditional Name: 6-ethyl-4-methyl-5-(phenylthio)cyclohex-4-ene-1,3-quinone Formula: C15H16O2S MolecularWeight: 260.35134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)CC(=O)C(=C1SC2=CC=CC=C2)C

Isomeric SMILES

CCC1C(=O)CC(=O)C(=C1SC2=CC=CC=C2)C

InChI

InChI=1S/C15H16O2S/c1-3-12-14(17)9-13(16)10(2)15(12)18-11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3