(2,6-dimethylphenyl) 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: (2,6-dimethylphenyl) 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (2,6-dimethylphenyl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (2,6-dimethylphenyl) ester Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO5S/c1-11-6-5-7-12(2)17(11)23-24(20,21)14-8-9-16(22-4)15(10-14)18-13(3)19/h5-10H,1-4H3,(H,18,19)