hydrogen sulfate; 4-(4-nitrophenyl)-1,3-dithiol-1-ium

Systemtic Name: hydrogen sulfate; 4-(4-nitrophenyl)-1,3-dithiol-1-ium Openeye Name: hydrogen sulfate; 4-(4-nitrophenyl)-1,3-dithiol-1-ium CAS Name: hydrogen sulfate; 4-(4-nitrophenyl)-1,3-dithiol-1-ium IUPAC Name: hydrogen sulfate; 4-(4-nitrophenyl)-1,3-dithiol-1-ium Traditional Name: 4-(4-nitrophenyl)-1,3-dithiol-1-ium bisulfate Formula: C9H7NO6S3 MolecularWeight: 321.34998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C[S+]=CS2)[N+](=O)[O-].OS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C[S+]=CS2)[N+](=O)[O-].OS(=O)(=O)[O-]

InChI

InChI=1S/C9H6NO2S2.H2O4S/c11-10(12)8-3-1-7(2-4-8)9-5-13-6-14-9;1-5(2,3)4/h1-6H;(H2,1,2,3,4)/q+1;/p-1