(3,4-dichlorophenyl) 2-methoxy-4-nitro-benzenesulfonate

Systemtic Name: (3,4-dichlorophenyl) 2-methoxy-4-nitro-benzenesulfonate Openeye Name: (3,4-dichlorophenyl) 2-methoxy-4-nitro-benzenesulfonate CAS Name: 2-methoxy-4-nitrobenzenesulfonic acid (3,4-dichlorophenyl) ester IUPAC Name: (3,4-dichlorophenyl) 2-methoxy-4-nitrobenzenesulfonate Traditional Name: 2-methoxy-4-nitro-benzenesulfonic acid (3,4-dichlorophenyl) ester Formula: C13H9Cl2NO6S MolecularWeight: 378.18466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H9Cl2NO6S/c1-21-12-6-8(16(17)18)2-5-13(12)23(19,20)22-9-3-4-10(14)11(15)7-9/h2-7H,1H3