6,6-ditert-butyl-4-phenylsulfanyl-cyclohexa-2,4-diene-1,1-diol

Systemtic Name: 6,6-ditert-butyl-4-phenylsulfanyl-cyclohexa-2,4-diene-1,1-diol Openeye Name: 6,6-ditert-butyl-4-phenylsulfanyl-cyclohexa-2,4-diene-1,1-diol CAS Name: 6,6-ditert-butyl-4-(phenylthio)cyclohexa-2,4-diene-1,1-diol IUPAC Name: 6,6-ditert-butyl-4-phenylsulfanylcyclohexa-2,4-diene-1,1-diol Traditional Name: 6,6-ditert-butyl-4-(phenylthio)cyclohexa-2,4-diene-1,1-diol Formula: C20H28O2S MolecularWeight: 332.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C=C(C=CC1(O)O)SC2=CC=CC=C2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1(C=C(C=CC1(O)O)SC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C20H28O2S/c1-17(2,3)19(18(4,5)6)14-16(12-13-20(19,21)22)23-15-10-8-7-9-11-15/h7-14,21-22H,1-6H3