4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one

Systemtic Name: 4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one Openeye Name: 4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one CAS Name: 4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one IUPAC Name: 4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one Traditional Name: 4-nitro-6-(trifluoromethyl)-1,3-benzodithiol-2-one Formula: C8H2F3NO3S2 MolecularWeight: 281.23159

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C1[N+](=O)[O-])SC(=O)S2)C(F)(F)F

Isomeric SMILES

C1=C(C=C2C(=C1[N+](=O)[O-])SC(=O)S2)C(F)(F)F

InChI

InChI=1S/C8H2F3NO3S2/c9-8(10,11)3-1-4(12(14)15)6-5(2-3)16-7(13)17-6/h1-2H