las-188638 (Q27294133)

UNII-Y19J0IW68J (English)

14 October 2016

chemical formula

C₁₆H₂₄NO₃⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1C[N+]2(CCC1C(C2)O)CCCOC3=CC=C(C=C3)O

1 reference

UNII-Y19J0IW68J (English)

14 October 2016

isomeric SMILES

C1C[N+]2(CCC1[C@H](C2)O)CCCOC3=CC=C(C=C3)O

1 reference

UNII-Y19J0IW68J (English)

InChI=1S/C16H23NO3/c18-14-2-4-15(5-3-14)20-11-1-8-17-9-6-13(7-10-17)16(19)12-17/h2-5,13,16,19H,1,6-12H2/p+1/t13?,16-,17?/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-Y19J0IW68J (English)

GEEJJFZMTJKMFZ-PWZRNIHTSA-O

14 October 2016

InChIKey

1 reference

UNII-Y19J0IW68J (English)

14 October 2016

1 reference

(3R)-3-Hydroxy-1-[3-(4-hydroxyphenoxy)propyl]-1-azoniabicyclo[2.2.2]octane (English)

14 October 2016

1 reference

Global Substance Registration System

UNII-Y19J0IW68J (English)

14 October 2016

1 reference

2 references

UNII

Y19J0IW68J

las-188638 (English)