3-nitro-4-(2-nitro-4-sulfo-phenyl)benzenesulfonic acid

Systemtic Name: 3-nitro-4-(2-nitro-4-sulfo-phenyl)benzenesulfonic acid Openeye Name: 3-nitro-4-(2-nitro-4-sulfo-phenyl)benzenesulfonic acid CAS Name: 3-nitro-4-(2-nitro-4-sulfophenyl)benzenesulfonic acid IUPAC Name: 3-nitro-4-(2-nitro-4-sulfophenyl)benzenesulfonic acid Traditional Name: 3-nitro-4-(2-nitro-4-sulfo-phenyl)besylic acid Formula: C12H8N2O10S2 MolecularWeight: 404.32932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])C2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)O)[N+](=O)[O-])C2=C(C=C(C=C2)S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O10S2/c15-13(16)11-5-7(25(19,20)21)1-3-9(11)10-4-2-8(26(22,23)24)6-12(10)14(17)18/h1-6H,(H,19,20,21)(H,22,23,24)