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Details

Stereochemistry RACEMIC
Molecular Formula C22H27NO2.ClH
Molecular Weight 373.916
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROXIBUTENE HYDROCHLORIDE

SMILES

Cl.CCC(=O)OC(CC1=CC=CC=C1)(C(=C)CN(C)C)C2=CC=CC=C2

InChI

InChIKey=IUGRFUJLVWXMNH-UHFFFAOYSA-N
InChI=1S/C22H27NO2.ClH/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19;/h6-15H,2,5,16-17H2,1,3-4H3;1H

HIDE SMILES / InChI

Molecular Formula C22H27NO2
Molecular Weight 337.4553
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:20:13 GMT 2023
Edited
by admin
on Sat Dec 16 10:20:13 GMT 2023
Record UNII
K3KLL9V7UI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROXIBUTENE HYDROCHLORIDE
Common Name English
BENZENEETHANOL, .ALPHA.-(1-((DIMETHYLAMINO)METHYL)ETHENYL)-.ALPHA.-PHENYL-, 1-PROPANOATE, HYDROCHLORIDE (1:1)
Systematic Name English
3-BUTEN-2-OL, 3-((DIMETHYLAMINO)METHYL)-1,2-DIPHENYL-, PROPIONATE (ESTER), HYDROCHLORIDE
Common Name English
DL-1,2-DIPHENYL-2-PROPIONYLOXY-3-(DIMETHYLAMINOMETHYL)-3-BUTENE HYDROCHLORIDE
Common Name English
Code System Code Type Description
FDA UNII
K3KLL9V7UI
Created by admin on Sat Dec 16 10:20:13 GMT 2023 , Edited by admin on Sat Dec 16 10:20:13 GMT 2023
PRIMARY
PUBCHEM
154926043
Created by admin on Sat Dec 16 10:20:13 GMT 2023 , Edited by admin on Sat Dec 16 10:20:13 GMT 2023
PRIMARY
CAS
37554-10-2
Created by admin on Sat Dec 16 10:20:13 GMT 2023 , Edited by admin on Sat Dec 16 10:20:13 GMT 2023
SUPERSEDED
CAS
14089-85-1
Created by admin on Sat Dec 16 10:20:13 GMT 2023 , Edited by admin on Sat Dec 16 10:20:13 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY