(2-propan-2-ylphenyl) 4-nitrobenzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 4-nitrobenzenesulfonate Openeye Name: (2-isopropylphenyl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid o-cumenyl ester Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15NO5S/c1-11(2)14-5-3-4-6-15(14)21-22(19,20)13-9-7-12(8-10-13)16(17)18/h3-11H,1-2H3