2-(3,3-diphenylpropyl)-4-methyl-benzenesulfonate

Systemtic Name: 2-(3,3-diphenylpropyl)-4-methyl-benzenesulfonate Openeye Name: 2-(3,3-diphenylpropyl)-4-methyl-benzenesulfonate CAS Name: 2-(3,3-diphenylpropyl)-4-methylbenzenesulfonate IUPAC Name: 2-(3,3-diphenylpropyl)-4-methylbenzenesulfonate Traditional Name: 2-(3,3-diphenylpropyl)-4-methyl-besylate Formula: C22H21O3S- MolecularWeight: 365.46534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)[O-])CCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22O3S/c1-17-12-15-22(26(23,24)25)20(16-17)13-14-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-12,15-16,21H,13-14H2,1H3,(H,23,24,25)/p-1