(4-nitrophenyl) 4-bromanyl-2-chloranyl-benzenesulfonate

Systemtic Name: (4-nitrophenyl) 4-bromanyl-2-chloranyl-benzenesulfonate Openeye Name: (4-nitrophenyl) 4-bromo-2-chloro-benzenesulfonate CAS Name: 4-bromo-2-chlorobenzenesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-bromo-2-chlorobenzenesulfonate Traditional Name: 4-bromo-2-chloro-benzenesulfonic acid (4-nitrophenyl) ester Formula: C12H7BrClNO5S MolecularWeight: 392.60968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7BrClNO5S/c13-8-1-6-12(11(14)7-8)21(18,19)20-10-4-2-9(3-5-10)15(16)17/h1-7H