[(4-nitrophenyl)carbonylamino]carbamothioylsulfamic acid

Systemtic Name: [(4-nitrophenyl)carbonylamino]carbamothioylsulfamic acid Openeye Name: [(4-nitrobenzoyl)amino]carbamothioylsulfamic acid CAS Name: [[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]sulfamic acid IUPAC Name: [(4-nitrobenzoyl)amino]carbamothioylsulfamic acid Traditional Name: [(4-nitrobenzoyl)amino]thiocarbamoylsulfamic acid Formula: C8H8N4O6S2 MolecularWeight: 320.30232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NNC(=S)NS(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NNC(=S)NS(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H8N4O6S2/c13-7(9-10-8(19)11-20(16,17)18)5-1-3-6(4-2-5)12(14)15/h1-4H,(H,9,13)(H2,10,11,19)(H,16,17,18)