tert-butyl 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: tert-butyl 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: tert-butyl 2-(tert-butoxycarbonylamino)-3-[3-(p-tolylsulfonyloxy)phenyl]propanoate CAS Name: 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3-tosyloxyphenyl)propionic acid tert-butyl ester Formula: C25H33NO7S MolecularWeight: 491.59702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)CC(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)CC(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C25H33NO7S/c1-17-11-13-20(14-12-17)34(29,30)33-19-10-8-9-18(15-19)16-21(22(27)31-24(2,3)4)26-23(28)32-25(5,6)7/h8-15,21H,16H2,1-7H3,(H,26,28)