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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22NO3.I
Molecular Weight 439.2874
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIMETHYLSPARSIFLORINIUM IODIDE

SMILES

[I-].[H][C@]12CC3=C(C=C(O)C=C3)C4=C1C(CC[N+]2(C)C)=CC(OC)=C4O

InChI

InChIKey=FPDGINIKQKRKTG-RSAXXLAASA-N
InChI=1S/C19H21NO3.HI/c1-20(2)7-6-12-9-16(23-3)19(22)18-14-10-13(21)5-4-11(14)8-15(20)17(12)18;/h4-5,9-10,15H,6-8H2,1-3H3,(H-,21,22);1H/t15-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H21NO3
Molecular Weight 311.3749
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:37:15 GMT 2023
Edited
by admin
on Sat Dec 16 09:37:15 GMT 2023
Record UNII
19KK440S5J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-DIMETHYLSPARSIFLORINIUM IODIDE
Common Name English
SPARSIFLORINE N-METHYL METHIODIDE [MI]
Common Name English
SPARSIFLORINE N-METHYL METHIODIDE
MI  
Common Name English
Code System Code Type Description
CAS
100023-75-4
Created by admin on Sat Dec 16 09:37:15 GMT 2023 , Edited by admin on Sat Dec 16 09:37:15 GMT 2023
PRIMARY
FDA UNII
19KK440S5J
Created by admin on Sat Dec 16 09:37:15 GMT 2023 , Edited by admin on Sat Dec 16 09:37:15 GMT 2023
PRIMARY
PUBCHEM
90478528
Created by admin on Sat Dec 16 09:37:15 GMT 2023 , Edited by admin on Sat Dec 16 09:37:15 GMT 2023
PRIMARY
MERCK INDEX
m470
Created by admin on Sat Dec 16 09:37:15 GMT 2023 , Edited by admin on Sat Dec 16 09:37:15 GMT 2023
PRIMARY Merck Index