(3,5-dimethylphenyl) 4-acetamidobenzenesulfonate

Systemtic Name: (3,5-dimethylphenyl) 4-acetamidobenzenesulfonate Openeye Name: (3,5-dimethylphenyl) 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (3,5-dimethylphenyl) ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

InChI

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