(2,3-dimethylphenyl) 5-acetamido-2-methyl-benzenesulfonate

Systemtic Name: (2,3-dimethylphenyl) 5-acetamido-2-methyl-benzenesulfonate Openeye Name: (2,3-dimethylphenyl) 5-acetamido-2-methyl-benzenesulfonate CAS Name: 5-acetamido-2-methylbenzenesulfonic acid (2,3-dimethylphenyl) ester IUPAC Name: (2,3-dimethylphenyl) 5-acetamido-2-methylbenzenesulfonate Traditional Name: 5-acetamido-2-methyl-benzenesulfonic acid (2,3-dimethylphenyl) ester Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4S/c1-11-6-5-7-16(13(11)3)22-23(20,21)17-10-15(18-14(4)19)9-8-12(17)2/h5-10H,1-4H3,(H,18,19)