(2-acetamidophenyl) 4-tert-butyl-2,6-dimethyl-benzenesulfonate

Systemtic Name: (2-acetamidophenyl) 4-tert-butyl-2,6-dimethyl-benzenesulfonate Openeye Name: (2-acetamidophenyl) 4-tert-butyl-2,6-dimethyl-benzenesulfonate CAS Name: 4-tert-butyl-2,6-dimethylbenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 4-tert-butyl-2,6-dimethylbenzenesulfonate Traditional Name: 4-tert-butyl-2,6-dimethyl-benzenesulfonic acid (2-acetamidophenyl) ester Formula: C20H25NO4S MolecularWeight: 375.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)OC2=CC=CC=C2NC(=O)C)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)OC2=CC=CC=C2NC(=O)C)C)C(C)(C)C

InChI

InChI=1S/C20H25NO4S/c1-13-11-16(20(4,5)6)12-14(2)19(13)26(23,24)25-18-10-8-7-9-17(18)21-15(3)22/h7-12H,1-6H3,(H,21,22)