(2-acetamidophenyl) 2,5-dimethylbenzenesulfonate

Systemtic Name: (2-acetamidophenyl) 2,5-dimethylbenzenesulfonate Openeye Name: (2-acetamidophenyl) 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid (2-acetamidophenyl) ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC=C2NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC=C2NC(=O)C

InChI

InChI=1S/C16H17NO4S/c1-11-8-9-12(2)16(10-11)22(19,20)21-15-7-5-4-6-14(15)17-13(3)18/h4-10H,1-3H3,(H,17,18)