(4-acetamidonaphthalen-1-yl) 4-tert-butylbenzenesulfonate

Systemtic Name: (4-acetamidonaphthalen-1-yl) 4-tert-butylbenzenesulfonate Openeye Name: (4-acetamido-1-naphthyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (4-acetamido-1-naphthalenyl) ester IUPAC Name: (4-acetamidonaphthalen-1-yl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (4-acetamido-1-naphthyl) ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C2=CC=CC=C21)OS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C2=CC=CC=C21)OS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H23NO4S/c1-15(24)23-20-13-14-21(19-8-6-5-7-18(19)20)27-28(25,26)17-11-9-16(10-12-17)22(2,3)4/h5-14H,1-4H3,(H,23,24)