(2S,5R,6R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-propyl-oxane-2-carboxylic acid

Systemtic Name: (2S,5R,6R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-propyl-oxane-2-carboxylic acid Openeye Name: (2S,5R,6R)-5-(tert-butoxycarbonylamino)-6-propyl-tetrahydropyran-2-carboxylic acid CAS Name: (2S,5R,6R)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-propyl-2-oxanecarboxylic acid IUPAC Name: (2S,5R,6R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-propyloxane-2-carboxylic acid Traditional Name: (2S,5R,6R)-5-(tert-butoxycarbonylamino)-6-propyl-tetrahydropyran-2-carboxylic acid Formula: C14H25NO5 MolecularWeight: 287.352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(CCC(O1)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC[C@@H]1[C@@H](CC[C@H](O1)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H25NO5/c1-5-6-10-9(7-8-11(19-10)12(16)17)15-13(18)20-14(2,3)4/h9-11H,5-8H2,1-4H3,(H,15,18)(H,16,17)/t9-,10-,11+/m1/s1