4-[(2,4-dinitrophenyl)amino]benzenesulfonic acid

Systemtic Name: 4-[(2,4-dinitrophenyl)amino]benzenesulfonic acid Openeye Name: 4-(2,4-dinitroanilino)benzenesulfonic acid CAS Name: 4-(2,4-dinitroanilino)benzenesulfonic acid IUPAC Name: 4-(2,4-dinitroanilino)benzenesulfonic acid Traditional Name: 4-(2,4-dinitroanilino)besylic acid Formula: C12H9N3O7S MolecularWeight: 339.28076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C12H9N3O7S/c16-14(17)9-3-6-11(12(7-9)15(18)19)13-8-1-4-10(5-2-8)23(20,21)22/h1-7,13H,(H,20,21,22)