tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-6-(phenylsulfonyl)hexanoate

Systemtic Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-6-(phenylsulfonyl)hexanoate Openeye Name: tert-butyl 6-(benzenesulfonyl)-2-(tert-butoxycarbonylamino)-5-oxo-hexanoate CAS Name: 6-(benzenesulfonyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxohexanoic acid tert-butyl ester IUPAC Name: tert-butyl 6-(benzenesulfonyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxohexanoate Traditional Name: 6-besyl-2-(tert-butoxycarbonylamino)-5-keto-hexanoic acid tert-butyl ester Formula: C21H31NO7S MolecularWeight: 441.53834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)CS(=O)(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC(=O)CS(=O)(=O)C1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO7S/c1-20(2,3)28-18(24)17(22-19(25)29-21(4,5)6)13-12-15(23)14-30(26,27)16-10-8-7-9-11-16/h7-11,17H,12-14H2,1-6H3,(H,22,25)