5-azanyl-2-[nitro(phenyl)amino]benzenesulfonic acid

Systemtic Name: 5-azanyl-2-[nitro(phenyl)amino]benzenesulfonic acid Openeye Name: 5-amino-2-(N-nitroanilino)benzenesulfonic acid CAS Name: 5-amino-2-(N-nitroanilino)benzenesulfonic acid IUPAC Name: 5-amino-2-(N-nitroanilino)benzenesulfonic acid Traditional Name: 5-amino-2-(N-nitroanilino)besylic acid Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=C(C=C(C=C2)N)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(C2=C(C=C(C=C2)N)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5S/c13-9-6-7-11(12(8-9)21(18,19)20)14(15(16)17)10-4-2-1-3-5-10/h1-8H,13H2,(H,18,19,20)