4-methyl-2-[5-nitro-2-(4-nitrophenoxy)peroxy-phenyl]benzenesulfonic acid

Systemtic Name: 4-methyl-2-[5-nitro-2-(4-nitrophenoxy)peroxy-phenyl]benzenesulfonic acid Openeye Name: 4-methyl-2-[5-nitro-2-(4-nitrophenoxy)peroxy-phenyl]benzenesulfonic acid CAS Name: 4-methyl-2-[5-nitro-2-(4-nitrophenoxy)dioxyphenyl]benzenesulfonic acid IUPAC Name: 4-methyl-2-[5-nitro-2-(4-nitrophenoxy)peroxyphenyl]benzenesulfonic acid Traditional Name: 4-methyl-2-[5-nitro-2-(4-nitrophenoxy)peroxy-phenyl]besylic acid Formula: C19H14N2O10S MolecularWeight: 462.38686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])OOOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])OOOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O10S/c1-12-2-9-19(32(26,27)28)17(10-12)16-11-14(21(24)25)5-8-18(16)30-31-29-15-6-3-13(4-7-15)20(22)23/h2-11H,1H3,(H,26,27,28)