methyl (2S,3R)-2-methyl-3-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl (2S,3R)-2-methyl-3-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl (2S,3R)-3-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]-2-methyl-4-oxo-butanoate CAS Name: (2S,3R)-2-methyl-3-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl (2S,3R)-2-methyl-3-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-oxobutanoate Traditional Name: (2S,3R)-3-[tert-butoxycarbonyl(tosyl)amino]-4-keto-2-methyl-butyric acid methyl ester Formula: C18H25NO7S MolecularWeight: 399.4586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25NO7S/c1-12-7-9-14(10-8-12)27(23,24)19(17(22)26-18(3,4)5)15(11-20)13(2)16(21)25-6/h7-11,13,15H,1-6H3/t13-,15-/m0/s1