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

Systemtic Name: methyl (2S)-2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-2-[4-(p-tolylsulfonyloxy)phenyl]acetate CAS Name: (2S)-2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl (2S)-2-[4-(4-methylphenyl)sulfonyloxyphenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-2-(4-tosyloxyphenyl)acetic acid methyl ester Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)[C@@H](C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H25NO7S/c1-14-6-12-17(13-7-14)30(25,26)29-16-10-8-15(9-11-16)18(19(23)27-5)22-20(24)28-21(2,3)4/h6-13,18H,1-5H3,(H,22,24)/t18-/m0/s1