2-hexadecylsulfanylcyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-hexadecylsulfanylcyclohexa-2,5-diene-1,4-dione Openeye Name: 2-hexadecylsulfanyl-1,4-benzoquinone CAS Name: 2-(hexadecylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-hexadecylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(cetylthio)-p-benzoquinone Formula: C22H36O2S MolecularWeight: 364.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC1=CC(=O)C=CC1=O

Isomeric SMILES

CCCCCCCCCCCCCCCCSC1=CC(=O)C=CC1=O

InChI

InChI=1S/C22H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-25-22-19-20(23)16-17-21(22)24/h16-17,19H,2-15,18H2,1H3