[4-(4-chlorophenyl)carbonylphenyl] 4-nitrobenzenesulfonate

Systemtic Name: [4-(4-chlorophenyl)carbonylphenyl] 4-nitrobenzenesulfonate Openeye Name: [4-(4-chlorobenzoyl)phenyl] 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid [4-[(4-chlorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-chlorobenzoyl)phenyl] 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid [4-(4-chlorobenzoyl)phenyl] ester Formula: C19H12ClNO6S MolecularWeight: 417.81968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H12ClNO6S/c20-15-5-1-13(2-6-15)19(22)14-3-9-17(10-4-14)27-28(25,26)18-11-7-16(8-12-18)21(23)24/h1-12H