methyl (2S)-6,6-dideuterio-2-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-enoate

Systemtic Name: methyl (2S)-6,6-dideuterio-2-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-enoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-6,6-dideuterio-hex-5-enoate CAS Name: (2S)-6,6-dideuterio-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-hexenoic acid methyl ester IUPAC Name: methyl (2S)-6,6-dideuterio-2-[(2-methylpropan-2-yl)oxycarbonylamino]hex-5-enoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-6,6-dideuterio-hex-5-enoic acid methyl ester Formula: C12H21NO4 MolecularWeight: 246.304418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H][13C](=CCC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C)[2H]

InChI

InChI=1S/C12H21NO4/c1-6-7-8-9(10(14)16-5)13-11(15)17-12(2,3)4/h6,9H,1,7-8H2,2-5H3,(H,13,15)/t9-/m0/s1/i1+1D2