(2S)-2-(hydroxymethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-enoic acid

Systemtic Name: (2S)-2-(hydroxymethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-enoic acid Openeye Name: (2S)-2-(tert-butoxycarbonylamino)-2-(hydroxymethyl)hept-6-enoic acid CAS Name: (2S)-2-(hydroxymethyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-heptenoic acid IUPAC Name: (2S)-2-(hydroxymethyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]hept-6-enoic acid Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-2-methylol-hept-6-enoic acid Formula: C13H23NO5 MolecularWeight: 273.32542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC=C)(CO)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@](CCCC=C)(CO)C(=O)O

InChI

InChI=1S/C13H23NO5/c1-5-6-7-8-13(9-15,10(16)17)14-11(18)19-12(2,3)4/h5,15H,1,6-9H2,2-4H3,(H,14,18)(H,16,17)/t13-/m0/s1