2-bromanyl-5,6-dimethyl-3-octadecylsulfanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-bromanyl-5,6-dimethyl-3-octadecylsulfanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-bromo-5,6-dimethyl-3-octadecylsulfanyl-1,4-benzoquinone CAS Name: 2-bromo-5,6-dimethyl-3-(octadecylthio)cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-bromo-5,6-dimethyl-3-octadecylsulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-bromo-5,6-dimethyl-3-(stearylthio)-p-benzoquinone Formula: C26H43BrO2S MolecularWeight: 499.58742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=C(C(=O)C(=C(C1=O)C)C)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=C(C(=O)C(=C(C1=O)C)C)Br

InChI

InChI=1S/C26H43BrO2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-30-26-23(27)24(28)21(2)22(3)25(26)29/h4-20H2,1-3H3