tert-butyl (2S,6R)-2-methyl-6-[(E,5S)-5-oxidanylhex-1-en-3-ynyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,6R)-2-methyl-6-[(E,5S)-5-oxidanylhex-1-en-3-ynyl]piperidine-1-carboxylate Openeye Name: tert-butyl (2R,6S)-2-[(E,5S)-5-hydroxyhex-1-en-3-ynyl]-6-methyl-piperidine-1-carboxylate CAS Name: (2R,6S)-2-[(E,5S)-5-hydroxyhex-1-en-3-ynyl]-6-methyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,6S)-2-[(E,5S)-5-hydroxyhex-1-en-3-ynyl]-6-methylpiperidine-1-carboxylate Traditional Name: (2R,6S)-2-[(E,5S)-5-hydroxyhex-1-en-3-ynyl]-6-methyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)OC(C)(C)C)C=CC#CC(C)O

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)OC(C)(C)C)/C=C/C#C[C@H](C)O

InChI

InChI=1S/C17H27NO3/c1-13-9-8-12-15(11-7-6-10-14(2)19)18(13)16(20)21-17(3,4)5/h7,11,13-15,19H,8-9,12H2,1-5H3/b11-7+/t13-,14-,15-/m0/s1