2-(2-chloranyl-3-nitro-phenyl)sulfanyl-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: 2-(2-chloranyl-3-nitro-phenyl)sulfanyl-2-oxidanylidene-ethanesulfonic acid Openeye Name: 2-(2-chloro-3-nitro-phenyl)sulfanyl-2-oxo-ethanesulfonic acid CAS Name: 2-[(2-chloro-3-nitrophenyl)thio]-2-oxoethanesulfonic acid IUPAC Name: 2-(2-chloro-3-nitrophenyl)sulfanyl-2-oxoethanesulfonic acid Traditional Name: 2-[(2-chloro-3-nitro-phenyl)thio]-2-keto-ethanesulfonic acid Formula: C8H6ClNO6S2 MolecularWeight: 311.71934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)SC(=O)CS(=O)(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)SC(=O)CS(=O)(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C8H6ClNO6S2/c9-8-5(10(12)13)2-1-3-6(8)17-7(11)4-18(14,15)16/h1-3H,4H2,(H,14,15,16)