cyclohexyl 3-(phenylsulfonylmethyl)benzoate

Systemtic Name: cyclohexyl 3-(phenylsulfonylmethyl)benzoate Openeye Name: cyclohexyl 3-(benzenesulfonylmethyl)benzoate CAS Name: 3-(benzenesulfonylmethyl)benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-(benzenesulfonylmethyl)benzoate Traditional Name: 3-(besylmethyl)benzoic acid cyclohexyl ester Formula: C20H22O4S MolecularWeight: 358.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22O4S/c21-20(24-18-10-3-1-4-11-18)17-9-7-8-16(14-17)15-25(22,23)19-12-5-2-6-13-19/h2,5-9,12-14,18H,1,3-4,10-11,15H2