(4-methyl-2-nitro-phenyl) 2,3-bis(chloranyl)benzenesulfonate

Systemtic Name: (4-methyl-2-nitro-phenyl) 2,3-bis(chloranyl)benzenesulfonate Openeye Name: (4-methyl-2-nitro-phenyl) 2,3-dichlorobenzenesulfonate CAS Name: 2,3-dichlorobenzenesulfonic acid (4-methyl-2-nitrophenyl) ester IUPAC Name: (4-methyl-2-nitrophenyl) 2,3-dichlorobenzenesulfonate Traditional Name: 2,3-dichlorobenzenesulfonic acid (4-methyl-2-nitro-phenyl) ester Formula: C13H9Cl2NO5S MolecularWeight: 362.18526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=C(C(=CC=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=C(C(=CC=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H9Cl2NO5S/c1-8-5-6-11(10(7-8)16(17)18)21-22(19,20)12-4-2-3-9(14)13(12)15/h2-7H,1H3