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Details

Stereochemistry ACHIRAL
Molecular Formula C21H18N5
Molecular Weight 340.4011
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 1

SHOW SMILES / InChI
Structure of 8-AZIDOETHIDIUM ION

SMILES

CC[N+]1=C(C2=CC=CC=C2)C3=CC(=CC=C3C4=C1C=C(N)C=C4)N=[N+]=[N-]

InChI

InChIKey=IMFJTOBLMOJLDM-UHFFFAOYSA-O
InChI=1S/C21H17N5/c1-2-26-20-12-15(22)8-10-18(20)17-11-9-16(24-25-23)13-19(17)21(26)14-6-4-3-5-7-14/h3-13,22H,2H2,1H3/p+1

HIDE SMILES / InChI

Molecular Formula C21H17N5
Molecular Weight 339.3932
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:00:20 GMT 2025
Edited
by admin
on Mon Mar 31 19:00:20 GMT 2025
Record UNII
XTR6FML56K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-AZIDOETHIDIUM
Preferred Name English
8-AZIDOETHIDIUM ION
Common Name English
PHENANTHRIDINIUM, 3-AMINO-8-AZIDO-5-ETHYL-6-PHENYL-
Systematic Name English
3-AMINO-8-AZIDO-5-ETHYL-6-PHENYLPHENANTHRIDINIUM
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30219724
Created by admin on Mon Mar 31 19:00:20 GMT 2025 , Edited by admin on Mon Mar 31 19:00:20 GMT 2025
PRIMARY
CAS
69498-50-6
Created by admin on Mon Mar 31 19:00:20 GMT 2025 , Edited by admin on Mon Mar 31 19:00:20 GMT 2025
PRIMARY
PUBCHEM
2762650
Created by admin on Mon Mar 31 19:00:20 GMT 2025 , Edited by admin on Mon Mar 31 19:00:20 GMT 2025
PRIMARY
FDA UNII
XTR6FML56K
Created by admin on Mon Mar 31 19:00:20 GMT 2025 , Edited by admin on Mon Mar 31 19:00:20 GMT 2025
PRIMARY
Related Record Type Details
IONIC MOIETY