(1S,2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-cyclohexane-1-carboxylic acid Openeye Name: (1S,2S,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-cyclohexanecarboxylic acid CAS Name: (1S,2S,3R)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2S,3R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclohexane-1-carboxylic acid Traditional Name: (1S,2S,3R)-2-(tert-butoxycarbonylamino)-3-hydroxy-cyclohexanecarboxylic acid Formula: C12H21NO5 MolecularWeight: 259.29884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1C(CCCC1O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO5/c1-12(2,3)18-11(17)13-9-7(10(15)16)5-4-6-8(9)14/h7-9,14H,4-6H2,1-3H3,(H,13,17)(H,15,16)/t7-,8+,9-/m0/s1