(2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-piperidine-2-carboxylate; (phenylmethyl)azanium

Systemtic Name: (2S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-piperidine-2-carboxylate; (phenylmethyl)azanium Openeye Name: benzylammonium; (2S,4S)-1-tert-butoxycarbonyl-4-hydroxy-piperidine-2-carboxylate CAS Name: (2S,4S)-4-hydroxy-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-piperidinecarboxylate; (phenylmethyl)ammonium IUPAC Name: benzylazanium; (2S,4S)-4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylate Traditional Name: benzylammonium; (2S,4S)-1-tert-butoxycarbonyl-4-hydroxy-pipecolinate Formula: C18H28N2O5 MolecularWeight: 352.42532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1C(=O)[O-])O.C1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H](C[C@H]1C(=O)[O-])O.C1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C11H19NO5.C7H9N/c1-11(2,3)17-10(16)12-5-4-7(13)6-8(12)9(14)15;8-6-7-4-2-1-3-5-7/h7-8,13H,4-6H2,1-3H3,(H,14,15);1-5H,6,8H2/t7-,8-;/m0./s1