ethyl 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate

Systemtic Name: ethyl 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate Openeye Name: ethyl 2-(tert-butoxycarbonylamino)-2-[4-(p-tolylsulfonyloxy)phenyl]acetate CAS Name: 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate Traditional Name: 2-(tert-butoxycarbonylamino)-2-(4-tosyloxyphenyl)acetic acid ethyl ester Formula: C22H27NO7S MolecularWeight: 449.51728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H27NO7S/c1-6-28-20(24)19(23-21(25)29-22(3,4)5)16-9-11-17(12-10-16)30-31(26,27)18-13-7-15(2)8-14-18/h7-14,19H,6H2,1-5H3,(H,23,25)