5-acetamido-2-azanyl-4-nitro-benzenesulfonic acid

Systemtic Name: 5-acetamido-2-azanyl-4-nitro-benzenesulfonic acid Openeye Name: 5-acetamido-2-amino-4-nitro-benzenesulfonic acid CAS Name: 5-acetamido-2-amino-4-nitrobenzenesulfonic acid IUPAC Name: 5-acetamido-2-amino-4-nitrobenzenesulfonic acid Traditional Name: 5-acetamido-2-amino-4-nitro-besylic acid Formula: C8H9N3O6S MolecularWeight: 275.23856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)S(=O)(=O)O)N)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)S(=O)(=O)O)N)[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O6S/c1-4(12)10-6-3-8(18(15,16)17)5(9)2-7(6)11(13)14/h2-3H,9H2,1H3,(H,10,12)(H,15,16,17)