[3,5-bis(chloranyl)phenyl] 4-azanyl-3-nitro-benzenesulfonate

Systemtic Name: [3,5-bis(chloranyl)phenyl] 4-azanyl-3-nitro-benzenesulfonate Openeye Name: (3,5-dichlorophenyl) 4-amino-3-nitro-benzenesulfonate CAS Name: 4-amino-3-nitrobenzenesulfonic acid (3,5-dichlorophenyl) ester IUPAC Name: (3,5-dichlorophenyl) 4-amino-3-nitrobenzenesulfonate Traditional Name: 4-amino-3-nitro-benzenesulfonic acid (3,5-dichlorophenyl) ester Formula: C12H8Cl2N2O5S MolecularWeight: 363.17332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1S(=O)(=O)OC2=CC(=CC(=C2)Cl)Cl)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1S(=O)(=O)OC2=CC(=CC(=C2)Cl)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C12H8Cl2N2O5S/c13-7-3-8(14)5-9(4-7)21-22(19,20)10-1-2-11(15)12(6-10)16(17)18/h1-6H,15H2