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Details

Stereochemistry ACHIRAL
Molecular Formula C13H17NO3
Molecular Weight 235.279
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPYNYL

SMILES

COC1=CC(CCN)=CC(OC)=C1OCC#C

InChI

InChIKey=KNIWBMMJSJHUJB-UHFFFAOYSA-N
InChI=1S/C13H17NO3/c1-4-7-17-13-11(15-2)8-10(5-6-14)9-12(13)16-3/h1,8-9H,5-7,14H2,2-3H3

HIDE SMILES / InChI

Molecular Formula C13H17NO3
Molecular Weight 235.279
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:59:26 GMT 2023
Edited
by admin
on Sat Dec 16 16:59:26 GMT 2023
Record UNII
5AG5MZJ75G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROPYNYL
Common Name English
4-propynyloxy-3,5-dimethoxyphenethylamine
Systematic Name English
3,5-DIMETHOXY-4-(2-PROPYN-1-YLOXY)BENZENEETHANAMINE
Systematic Name English
BENZENEETHANAMINE, 3,5-DIMETHOXY-4-(2-PROPYN-1-YLOXY)-
Systematic Name English
PROPYNYL (PSYCHEDELIC)
Common Name English
Classification Tree Code System Code
WIKIPEDIA PiHKAL
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
Code System Code Type Description
CAS
952017-05-9
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
PRIMARY
PUBCHEM
44719613
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
PRIMARY
FDA UNII
5AG5MZJ75G
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
PRIMARY
WIKIPEDIA
Propynyl (psychedelic)
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID50660375
Created by admin on Sat Dec 16 16:59:26 GMT 2023 , Edited by admin on Sat Dec 16 16:59:26 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY