(2-acetamidophenyl) 3-methyl-4-propan-2-yloxy-benzenesulfonate

Systemtic Name: (2-acetamidophenyl) 3-methyl-4-propan-2-yloxy-benzenesulfonate Openeye Name: (2-acetamidophenyl) 4-isopropoxy-3-methyl-benzenesulfonate CAS Name: 3-methyl-4-propan-2-yloxybenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 3-methyl-4-propan-2-yloxybenzenesulfonate Traditional Name: 4-isopropoxy-3-methyl-benzenesulfonic acid (2-acetamidophenyl) ester Formula: C18H21NO5S MolecularWeight: 363.42804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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