3-chloranyl-2,6-bis(2-hydroxyethyl)-5-nitro-benzenesulfinic acid

Systemtic Name: 3-chloranyl-2,6-bis(2-hydroxyethyl)-5-nitro-benzenesulfinic acid Openeye Name: 3-chloro-2,6-bis(2-hydroxyethyl)-5-nitro-benzenesulfinic acid CAS Name: 3-chloro-2,6-bis(2-hydroxyethyl)-5-nitrobenzenesulfinic acid IUPAC Name: 3-chloro-2,6-bis(2-hydroxyethyl)-5-nitrobenzenesulfinic acid Traditional Name: 3-chloro-2,6-bis(2-hydroxyethyl)-5-nitro-benzenesulfinic acid Formula: C10H12ClNO6S MolecularWeight: 309.72338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1Cl)CCO)S(=O)O)CCO)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=C(C(=C1Cl)CCO)S(=O)O)CCO)[N+](=O)[O-]

InChI

InChI=1S/C10H12ClNO6S/c11-8-5-9(12(15)16)7(2-4-14)10(19(17)18)6(8)1-3-13/h5,13-14H,1-4H2,(H,17,18)