2-dodecylsulfanyl-8-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2-dodecylsulfanyl-8-oxidanyl-naphthalene-1,4-dione Openeye Name: 2-dodecylsulfanyl-8-hydroxy-naphthalene-1,4-dione CAS Name: 2-(dodecylthio)-8-hydroxynaphthalene-1,4-dione IUPAC Name: 2-dodecylsulfanyl-8-hydroxynaphthalene-1,4-dione Traditional Name: 8-hydroxy-2-(laurylthio)-1,4-naphthoquinone Formula: C22H30O3S MolecularWeight: 374.5368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=CC(=O)C2=C(C1=O)C(=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCSC1=CC(=O)C2=C(C1=O)C(=CC=C2)O

InChI

InChI=1S/C22H30O3S/c1-2-3-4-5-6-7-8-9-10-11-15-26-20-16-19(24)17-13-12-14-18(23)21(17)22(20)25/h12-14,16,23H,2-11,15H2,1H3