(3S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-[(E)-5-oxidanylpent-3-enyl]piperidine-4-carboxylic acid

Systemtic Name: (3S,4S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-[(E)-5-oxidanylpent-3-enyl]piperidine-4-carboxylic acid Openeye Name: (3S,4S)-1-tert-butoxycarbonyl-3-[(E)-5-hydroxypent-3-enyl]piperidine-4-carboxylic acid CAS Name: (3S,4S)-3-[(E)-5-hydroxypent-3-enyl]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: (3S,4S)-3-[(E)-5-hydroxypent-3-enyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid Traditional Name: (3S,4S)-1-tert-butoxycarbonyl-3-[(E)-5-hydroxypent-3-enyl]isonipecotic acid Formula: C16H27NO5 MolecularWeight: 313.38928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)CCC=CCO)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](C1)CC/C=C/CO)C(=O)O

InChI

InChI=1S/C16H27NO5/c1-16(2,3)22-15(21)17-9-8-13(14(19)20)12(11-17)7-5-4-6-10-18/h4,6,12-13,18H,5,7-11H2,1-3H3,(H,19,20)/b6-4+/t12-,13+/m1/s1