6-azanyl-2-nitro-3-phenylazanyl-benzenesulfonic acid

Systemtic Name: 6-azanyl-2-nitro-3-phenylazanyl-benzenesulfonic acid Openeye Name: 6-amino-3-anilino-2-nitro-benzenesulfonic acid CAS Name: 6-amino-3-anilino-2-nitrobenzenesulfonic acid IUPAC Name: 6-amino-3-anilino-2-nitrobenzenesulfonic acid Traditional Name: 6-amino-3-anilino-2-nitro-besylic acid Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=C(C=C2)N)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=C(C=C2)N)S(=O)(=O)O)[N+](=O)[O-]

InChI

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