(2-oxidanylidene-1,2-diphenyl-ethyl) 3-nitrobenzenesulfonate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 3-nitrobenzenesulfonate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid desyl ester Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15NO6S/c22-19(15-8-3-1-4-9-15)20(16-10-5-2-6-11-16)27-28(25,26)18-13-7-12-17(14-18)21(23)24/h1-14,20H