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

Systemtic Name: ethyl 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 3-[3-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3-tosyloxyphenyl)propionic acid ethyl ester Formula: C23H29NO7S MolecularWeight: 463.54386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H29NO7S/c1-6-29-21(25)20(24-22(26)30-23(3,4)5)15-17-8-7-9-18(14-17)31-32(27,28)19-12-10-16(2)11-13-19/h7-14,20H,6,15H2,1-5H3,(H,24,26)