tert-butyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylsulfonyl)pentanoate

Systemtic Name: tert-butyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylsulfonyl)pentanoate Openeye Name: tert-butyl (2S)-5-(benzenesulfonyl)-2-(tert-butoxycarbonylamino)pentanoate CAS Name: (2S)-5-(benzenesulfonyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-5-(benzenesulfonyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-5-besyl-2-(tert-butoxycarbonylamino)valeric acid tert-butyl ester Formula: C20H31NO6S MolecularWeight: 413.52824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCS(=O)(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CCCS(=O)(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H31NO6S/c1-19(2,3)26-17(22)16(21-18(23)27-20(4,5)6)13-10-14-28(24,25)15-11-8-7-9-12-15/h7-9,11-12,16H,10,13-14H2,1-6H3,(H,21,23)/t16-/m0/s1