(2-ethyl-4-nitro-6-sulfamoyl-phenyl)-methyl-sulfamic acid

Systemtic Name: (2-ethyl-4-nitro-6-sulfamoyl-phenyl)-methyl-sulfamic acid Openeye Name: (2-ethyl-4-nitro-6-sulfamoyl-phenyl)-methyl-sulfamic acid CAS Name: (2-ethyl-4-nitro-6-sulfamoylphenyl)-methylsulfamic acid IUPAC Name: (2-ethyl-4-nitro-6-sulfamoylphenyl)-methylsulfamic acid Traditional Name: (2-ethyl-4-nitro-6-sulfamoyl-phenyl)-methyl-sulfamic acid Formula: C9H13N3O7S2 MolecularWeight: 339.34542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1N(C)S(=O)(=O)O)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=CC(=C1N(C)S(=O)(=O)O)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O7S2/c1-3-6-4-7(12(13)14)5-8(20(10,15)16)9(6)11(2)21(17,18)19/h4-5H,3H2,1-2H3,(H2,10,15,16)(H,17,18,19)