methyl (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]-2-phenyl-acetate CAS Name: (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[tert-butoxycarbonyl(tosyl)amino]-2-phenyl-acetic acid methyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(C2=CC=CC=C2)C(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6S/c1-15-11-13-17(14-12-15)29(25,26)22(20(24)28-21(2,3)4)18(19(23)27-5)16-9-7-6-8-10-16/h6-14,18H,1-5H3/t18-/m0/s1