3-[(2-azanyl-4-nitro-phenyl)amino]benzenesulfonic acid

Systemtic Name: 3-[(2-azanyl-4-nitro-phenyl)amino]benzenesulfonic acid Openeye Name: 3-(2-amino-4-nitro-anilino)benzenesulfonic acid CAS Name: 3-(2-amino-4-nitroanilino)benzenesulfonic acid IUPAC Name: 3-(2-amino-4-nitroanilino)benzenesulfonic acid Traditional Name: 3-(2-amino-4-nitro-anilino)besylic acid Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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