(4-nitrophenyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (4-nitrophenyl) 4-tert-butylbenzenesulfonate Openeye Name: (4-nitrophenyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (4-nitrophenyl) ester Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO5S/c1-16(2,3)12-4-10-15(11-5-12)23(20,21)22-14-8-6-13(7-9-14)17(18)19/h4-11H,1-3H3