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

Systemtic Name: 4-[[4-[(2,4-dinitrophenyl)-nitroso-amino]phenyl]diazenyl]benzenesulfonic acid Openeye Name: 4-[4-(2,4-dinitro-N-nitroso-anilino)phenyl]azobenzenesulfonic acid CAS Name: 4-[4-(2,4-dinitro-N-nitrosoanilino)phenyl]azobenzenesulfonic acid IUPAC Name: 4-[[4-(2,4-dinitro-N-nitrosoanilino)phenyl]diazenyl]benzenesulfonic acid Traditional Name: 4-[4-(2,4-dinitro-N-nitroso-anilino)phenyl]azobesylic acid Formula: C18H12N6O8S MolecularWeight: 472.38828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N(C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])N=O

Isomeric SMILES

C1=CC(=CC=C1N=NC2=CC=C(C=C2)S(=O)(=O)O)N(C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])N=O

InChI

InChI=1S/C18H12N6O8S/c25-21-22(17-10-7-15(23(26)27)11-18(17)24(28)29)14-5-1-12(2-6-14)19-20-13-3-8-16(9-4-13)33(30,31)32/h1-11H,(H,30,31,32)