3-aminocarbonyl-5-nitro-benzenesulfonate

Systemtic Name: 3-aminocarbonyl-5-nitro-benzenesulfonate Openeye Name: 3-carbamoyl-5-nitro-benzenesulfonate CAS Name: 3-carbamoyl-5-nitrobenzenesulfonate IUPAC Name: 3-carbamoyl-5-nitrobenzenesulfonate Traditional Name: 3-carbamoyl-5-nitro-besylate Formula: C7H5N2O6S- MolecularWeight: 245.1894

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])C(=O)N

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)[O-])C(=O)N

InChI

InChI=1S/C7H6N2O6S/c8-7(10)4-1-5(9(11)12)3-6(2-4)16(13,14)15/h1-3H,(H2,8,10)(H,13,14,15)/p-1