2,3-bis(hexylsulfanyl)naphthalene-1,4-dione

Systemtic Name: 2,3-bis(hexylsulfanyl)naphthalene-1,4-dione Openeye Name: 2,3-bis(hexylsulfanyl)naphthalene-1,4-dione CAS Name: 2,3-bis(hexylthio)naphthalene-1,4-dione IUPAC Name: 2,3-bis(hexylsulfanyl)naphthalene-1,4-dione Traditional Name: 2,3-bis(hexylthio)-1,4-naphthoquinone Formula: C22H30O2S2 MolecularWeight: 390.6024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=C(C(=O)C2=CC=CC=C2C1=O)SCCCCCC

Isomeric SMILES

CCCCCCSC1=C(C(=O)C2=CC=CC=C2C1=O)SCCCCCC

InChI

InChI=1S/C22H30O2S2/c1-3-5-7-11-15-25-21-19(23)17-13-9-10-14-18(17)20(24)22(21)26-16-12-8-6-4-2/h9-10,13-14H,3-8,11-12,15-16H2,1-2H3