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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H32N4.2I
Molecular Weight 630.3466
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N'-DIMETHYLCHIMONANTHINIUM DIIODIDE

SMILES

[I-].[I-].[H][C@@]12NC3=CC=CC=C3[C@@]1(CC[N+]2(C)C)[C@@]45CC[N+](C)(C)[C@]4([H])NC6=CC=CC=C56

InChI

InChIKey=MFEFYAUSQSXITJ-OPFSMVLFSA-L
InChI=1S/C24H32N4.2HI/c1-27(2)15-13-23(17-9-5-7-11-19(17)25-21(23)27)24-14-16-28(3,4)22(24)26-20-12-8-6-10-18(20)24;;/h5-12,21-22,25-26H,13-16H2,1-4H3;2*1H/q+2;;/p-2/t21-,22-,23+,24+;;/m0../s1

HIDE SMILES / InChI

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

Molecular Formula C24H32N4
Molecular Weight 376.5377
Charge 2
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:00:01 GMT 2023
Edited
by admin
on Sat Dec 16 10:00:01 GMT 2023
Record UNII
C9CQ8681R1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N'-DIMETHYLCHIMONANTHINIUM DIIODIDE
Common Name English
CHIMONANTHINE DIMETHIODIDE
MI  
Common Name English
3A,3'A(1H,1'H)-BIPYRROLO(2,3-B)INDOLIUM, 2,2',3,3',8,8',8A,8'A-OCTAHYDRO-1,1,1',1'-TETRAMETHYL-, IODIDE (1:2), (3AS,3'AS,8AS,8'AS)-
Systematic Name English
CHIMONANTHINE DIMETHIODIDE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m3329
Created by admin on Sat Dec 16 10:00:01 GMT 2023 , Edited by admin on Sat Dec 16 10:00:01 GMT 2023
PRIMARY Merck Index
PUBCHEM
73425476
Created by admin on Sat Dec 16 10:00:01 GMT 2023 , Edited by admin on Sat Dec 16 10:00:01 GMT 2023
PRIMARY
CAS
101296-94-0
Created by admin on Sat Dec 16 10:00:01 GMT 2023 , Edited by admin on Sat Dec 16 10:00:01 GMT 2023
PRIMARY
FDA UNII
C9CQ8681R1
Created by admin on Sat Dec 16 10:00:01 GMT 2023 , Edited by admin on Sat Dec 16 10:00:01 GMT 2023
PRIMARY