tert-butyl (E,4S,5S,6S)-6-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfonyloxy-oct-2-enoate

Systemtic Name: tert-butyl (E,4S,5S,6S)-6-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfonyloxy-oct-2-enoate Openeye Name: tert-butyl (E,4S,5S,6S)-5-(tert-butoxycarbonylamino)-6-methyl-4-methylsulfonyloxy-oct-2-enoate CAS Name: (E,4S,5S,6S)-6-methyl-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-methylsulfonyloxy-2-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,4S,5S,6S)-6-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfonyloxyoct-2-enoate Traditional Name: (E,4S,5S,6S)-5-(tert-butoxycarbonylamino)-6-methyl-4-methylsulfonyloxy-oct-2-enoic acid tert-butyl ester Formula: C19H35NO7S MolecularWeight: 421.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C=CC(=O)OC(C)(C)C)OS(=O)(=O)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@H](C)[C@@H]([C@H](/C=C/C(=O)OC(C)(C)C)OS(=O)(=O)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H35NO7S/c1-10-13(2)16(20-17(22)26-19(6,7)8)14(27-28(9,23)24)11-12-15(21)25-18(3,4)5/h11-14,16H,10H2,1-9H3,(H,20,22)/b12-11+/t13-,14-,16-/m0/s1