methyl (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-oxidanyl-hexanoate

Systemtic Name: methyl (2S)-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-oxidanyl-hexanoate Openeye Name: methyl (2S)-2-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]-5-hydroxy-hexanoate CAS Name: (2S)-5-hydroxy-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-5-hydroxy-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoate Traditional Name: (2S)-2-[tert-butoxycarbonyl(tosyl)amino]-5-hydroxy-hexanoic acid methyl ester Formula: C19H29NO7S MolecularWeight: 415.50106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO7S/c1-13-7-10-15(11-8-13)28(24,25)20(18(23)27-19(3,4)5)16(17(22)26-6)12-9-14(2)21/h7-8,10-11,14,16,21H,9,12H2,1-6H3/t14?,16-/m0/s1