sodium 1-methyl-4-nitro-2-oxidanidylperoxysulfanyl-benzene

Systemtic Name: sodium 1-methyl-4-nitro-2-oxidanidylperoxysulfanyl-benzene Openeye Name: sodium 1-methyl-4-nitro-2-oxidoperoxysulfanyl-benzene CAS Name: sodium 2-methyl-5-nitrobenzenesulfenic acid oxidooxy ester IUPAC Name: sodium 1-methyl-4-nitro-2-oxidoperoxysulfanylbenzene Traditional Name: sodium 1-methyl-4-nitro-2-(oxidoperoxythio)benzene Formula: C7H6NNaO5S MolecularWeight: 239.18101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])SOO[O-].[Na+]

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])SOO[O-].[Na+]

InChI

InChI=1S/C7H7NO5S.Na/c1-5-2-3-6(8(9)10)4-7(5)14-13-12-11;/h2-4,11H,1H3;/q;+1/p-1