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

Details

Stereochemistry ACHIRAL
Molecular Formula C34H52N4O5.2Cl
Molecular Weight 667.706
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DI-METHOXYCINNAMIDOPROPYL ETHYLDIMONIUM CHLORIDE ETHER

SMILES

[Cl-].[Cl-].COC1=CC=C(\C=C\C(=O)NCCC[N+](C)(C)CCOCC[N+](C)(C)CCCNC(=O)\C=C\C2=CC=C(OC)C=C2)C=C1

InChI

InChIKey=PLMVCRGAKDGNEA-HPKCLRQXSA-N
InChI=1S/C34H50N4O5.2ClH/c1-37(2,23-7-21-35-33(39)19-13-29-9-15-31(41-5)16-10-29)25-27-43-28-26-38(3,4)24-8-22-36-34(40)20-14-30-11-17-32(42-6)18-12-30;;/h9-20H,7-8,21-28H2,1-6H3;2*1H/b19-13+,20-14+;;

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C34H52N4O5
Molecular Weight 596.8005
Charge 2
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:50:14 GMT 2023
Edited
by admin
on Sat Dec 16 01:50:14 GMT 2023
Record UNII
6JVL75281S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DI-METHOXYCINNAMIDOPROPYL ETHYLDIMONIUM CHLORIDE ETHER
INCI  
INCI  
Official Name English
1-PROPANAMINIUM, N,N'-(OXYDI-2,1-ETHANEDIYL)BIS(3-((3-(4-METHOXYPHENYL)-1-OXO-2-PROPEN-1-YL)AMINO)-N,N-DIMETHYL-, CHLORIDE (1:2)
Systematic Name English
GALAXY - BISQUAT
Brand Name English
DI-METHOXYCINNAMIDOPROPYL ETHYLDIMONIUM CHLORIDE ETHER [INCI]
Common Name English
1-PROPANAMINIUM, N,N'-(OXYDI-2,1-ETHANEDIYL)BIS(3-((3-(4-METHOXYPHENYL)-1-OXO-2-PROPENYL)AMINO)-N,N-DIMETHYL-, DICHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
6JVL75281S
Created by admin on Sat Dec 16 01:50:14 GMT 2023 , Edited by admin on Sat Dec 16 01:50:14 GMT 2023
PRIMARY
PUBCHEM
22141786
Created by admin on Sat Dec 16 01:50:14 GMT 2023 , Edited by admin on Sat Dec 16 01:50:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID10196165
Created by admin on Sat Dec 16 01:50:14 GMT 2023 , Edited by admin on Sat Dec 16 01:50:14 GMT 2023
PRIMARY
CAS
444153-01-9
Created by admin on Sat Dec 16 01:50:14 GMT 2023 , Edited by admin on Sat Dec 16 01:50:14 GMT 2023
PRIMARY