(2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethyl-piperidin-1-ium-4-ol

Systemtic Name: (2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethyl-piperidin-1-ium-4-ol Openeye Name: (2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethyl-piperidin-1-ium-4-ol CAS Name: (2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethyl-4-piperidin-1-iumol IUPAC Name: (2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethylpiperidin-1-ium-4-ol Traditional Name: (2R,4R,5S)-4-[(E)-4-butoxybut-3-en-1-ynyl]-1,2,5-trimethyl-piperidin-1-ium-4-ol Formula: C16H28NO2+ MolecularWeight: 266.39902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC=CC#CC1(CC([NH+](CC1C)C)C)O

Isomeric SMILES

CCCCO/C=C/C#C[C@]1(C[C@H]([NH+](C[C@@H]1C)C)C)O

InChI

InChI=1S/C16H27NO2/c1-5-6-10-19-11-8-7-9-16(18)12-15(3)17(4)13-14(16)2/h8,11,14-15,18H,5-6,10,12-13H2,1-4H3/p+1/b11-8+/t14-,15+,16+/m0/s1