(2-propan-2-ylphenyl) 4-acetamido-3-methoxy-benzenesulfonate

Systemtic Name: (2-propan-2-ylphenyl) 4-acetamido-3-methoxy-benzenesulfonate Openeye Name: (2-isopropylphenyl) 4-acetamido-3-methoxy-benzenesulfonate CAS Name: 4-acetamido-3-methoxybenzenesulfonic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-acetamido-3-methoxybenzenesulfonate Traditional Name: 4-acetamido-3-methoxy-benzenesulfonic acid o-cumenyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1OS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C)OC

InChI

InChI=1S/C18H21NO5S/c1-12(2)15-7-5-6-8-17(15)24-25(21,22)14-9-10-16(19-13(3)20)18(11-14)23-4/h5-12H,1-4H3,(H,19,20)