6-phenylsulfanyl-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-dione

Systemtic Name: 6-phenylsulfanyl-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-dione Openeye Name: 6-phenylsulfanyl-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-dione CAS Name: 6-(phenylthio)-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-dione IUPAC Name: 6-phenylsulfanyl-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-dione Traditional Name: 6-(phenylthio)-2,3,4,4a,5,8a-hexahydronaphthalene-1,8-quinone Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(=CC(=O)C2C(=O)C1)SC3=CC=CC=C3

Isomeric SMILES

C1CC2CC(=CC(=O)C2C(=O)C1)SC3=CC=CC=C3

InChI

InChI=1S/C16H16O2S/c17-14-8-4-5-11-9-13(10-15(18)16(11)14)19-12-6-2-1-3-7-12/h1-3,6-7,10-11,16H,4-5,8-9H2