(2-chloranyl-4-cyano-phenyl) 4-methoxy-3-nitro-benzenesulfonate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 4-methoxy-3-nitro-benzenesulfonate Openeye Name: (2-chloro-4-cyano-phenyl) 4-methoxy-3-nitro-benzenesulfonate CAS Name: 4-methoxy-3-nitrobenzenesulfonic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 4-methoxy-3-nitrobenzenesulfonate Traditional Name: 4-methoxy-3-nitro-benzenesulfonic acid (2-chloro-4-cyano-phenyl) ester Formula: C14H9ClN2O6S MolecularWeight: 368.74906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9ClN2O6S/c1-22-14-5-3-10(7-12(14)17(18)19)24(20,21)23-13-4-2-9(8-16)6-11(13)15/h2-7H,1H3