U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C16H34N2O2.2I
Molecular Weight 540.2623
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICOLINIUM IODIDE

SMILES

[I-].[I-].CC[N+](C)(CC)CCOC(=O)C1CCCC(C)[N+]1(C)C

InChI

InChIKey=UHMKISIRZFDJRU-UHFFFAOYSA-L
InChI=1S/C16H34N2O2.2HI/c1-7-18(6,8-2)12-13-20-16(19)15-11-9-10-14(3)17(15,4)5;;/h14-15H,7-13H2,1-6H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula C16H34N2O2
Molecular Weight 286.4534
Charge 2
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula HI
Molecular Weight 127.9124
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:32:52 GMT 2023
Edited
by admin
on Fri Dec 15 17:32:52 GMT 2023
Record UNII
4L6L92S51P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DICOLINIUM IODIDE
INN   MART.  
INN  
Official Name English
DIKOLINE
Brand Name English
dicolinium iodide [INN]
Common Name English
DICHOLINE
Brand Name English
2-CARBOXY-1,1,6-TRIMETHYLPIPERIDINIUM IODIDE, ESTER WITH DIETHYL-(2-HYDROXYETHYL)METHYLAMMONIUM IODIDE
Common Name English
DICOLIN
Brand Name English
OF-816
Code English
DICOLINIUM IODIDE [MART.]
Common Name English
DIKOLIN
Brand Name English
PIPERIDINIUM, 2-((2-(DIETHYLMETHYLAMMONIO)ETHOXY)CARBONYL)-1,1,6-TRIMETHYL-, IODIDE (1:2)
Systematic Name English
DICOLINE
Brand Name English
Classification Tree Code System Code
NCI_THESAURUS C66886
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2110845
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID10959151
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
EVMPD
SUB07100MIG
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
PUBCHEM
71497
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
CAS
36231-40-0
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
ALTERNATIVE
FDA UNII
4L6L92S51P
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
SMS_ID
100000082940
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
NCI_THESAURUS
C80529
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
INN
3083
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
CAS
382-82-1
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
MESH
C016374
Created by admin on Fri Dec 15 17:32:52 GMT 2023 , Edited by admin on Fri Dec 15 17:32:52 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY