(2-chlorophenyl) 4-chloranyl-3-nitro-benzenesulfonate

Systemtic Name: (2-chlorophenyl) 4-chloranyl-3-nitro-benzenesulfonate Openeye Name: (2-chlorophenyl) 4-chloro-3-nitro-benzenesulfonate CAS Name: 4-chloro-3-nitrobenzenesulfonic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 4-chloro-3-nitrobenzenesulfonate Traditional Name: 4-chloro-3-nitro-benzenesulfonic acid (2-chlorophenyl) ester Formula: C12H7Cl2NO5S MolecularWeight: 348.15868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)OS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H7Cl2NO5S/c13-9-6-5-8(7-11(9)15(16)17)21(18,19)20-12-4-2-1-3-10(12)14/h1-7H