4-(2-hydroxyethylsulfonyl)-2-nitro-phenolate

Systemtic Name: 4-(2-hydroxyethylsulfonyl)-2-nitro-phenolate Openeye Name: 4-(2-hydroxyethylsulfonyl)-2-nitro-phenolate CAS Name: 4-(2-hydroxyethylsulfonyl)-2-nitrophenolate IUPAC Name: 4-(2-hydroxyethylsulfonyl)-2-nitrophenolate Traditional Name: 4-(2-hydroxyethylsulfonyl)-2-nitro-phenolate Formula: C8H8NO6S- MolecularWeight: 246.21722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9NO6S/c10-3-4-16(14,15)6-1-2-8(11)7(5-6)9(12)13/h1-2,5,10-11H,3-4H2/p-1