2,3-bis(methylsulfanyl)-6-nitro-naphthalene-1,4-dione

Systemtic Name: 2,3-bis(methylsulfanyl)-6-nitro-naphthalene-1,4-dione Openeye Name: 2,3-bis(methylsulfanyl)-6-nitro-naphthalene-1,4-dione CAS Name: 2,3-bis(methylthio)-6-nitronaphthalene-1,4-dione IUPAC Name: 2,3-bis(methylsulfanyl)-6-nitronaphthalene-1,4-dione Traditional Name: 2,3-bis(methylthio)-6-nitro-1,4-naphthoquinone Formula: C12H9NO4S2 MolecularWeight: 295.33416

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)C2=C(C1=O)C=CC(=C2)[N+](=O)[O-])SC

Isomeric SMILES

CSC1=C(C(=O)C2=C(C1=O)C=CC(=C2)[N+](=O)[O-])SC

InChI

InChI=1S/C12H9NO4S2/c1-18-11-9(14)7-4-3-6(13(16)17)5-8(7)10(15)12(11)19-2/h3-5H,1-2H3