[4-(2-phenylpropan-2-yl)phenyl] 4-acetamidobenzenesulfonate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 4-acetamidobenzenesulfonate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid (4-cumylphenyl) ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO4S/c1-17(25)24-20-11-15-22(16-12-20)29(26,27)28-21-13-9-19(10-14-21)23(2,3)18-7-5-4-6-8-18/h4-16H,1-3H3,(H,24,25)