endo-biperiden (Q27287250)

1-[(1S,2S,4S)-Bicyclo[2.2.1]hept-5-en-2-yl]-1-phenyl-3-(1-piperidinyl)-1-propanol (English)

14 October 2016

chemical formula

C₂₁H₂₉NO

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1=CC=C(C=C1)C(CCN2CCCCC2)(C3CC4CC3C=C4)O

1 reference

endo-biperiden (English)

14 October 2016

isomeric SMILES

C1=CC=C(C=C1)C(CCN2CCCCC2)([C@H]3C[C@@H]4C[C@H]3C=C4)O

1 reference

endo-biperiden (English)

InChI=1S/C21H29NO/c23-21(19-7-3-1-4-8-19,11-14-22-12-5-2-6-13-22)20-16-17-9-10-18(20)15-17/h1,3-4,7-10,17-18,20,23H,2,5-6,11-16H2/t17-,18+,20-,21?/m0/s1

14 October 2016

Identifiers

InChI

1 reference

endo-biperiden (English)

YSXKPIUOCJLQIE-PFTCBEMASA-N

14 October 2016

InChIKey

1 reference

endo-biperiden (English)

14 October 2016

1 reference

matched by identifier from

1-[(1S,2S,4S)-Bicyclo[2.2.1]hept-5-en-2-yl]-1-phenyl-3-(1-piperidinyl)-1-propanol (English)

14 October 2016

2 references

26 December 2021

InChIKey

YSXKPIUOCJLQIE-PFTCBEMASA-N

1 reference

1 reference

endo-biperiden (English)