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Details

Stereochemistry RACEMIC
Molecular Formula C17H27NO4.ClH
Molecular Weight 345.862
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACC-9129 HYDROCHLORIDE

SMILES

Cl.CCOC(=O)CCC1=CC=C(OCC(O)CNC(C)C)C=C1

InChI

InChIKey=QSBBFPADPPEDRS-UHFFFAOYSA-N
InChI=1S/C17H27NO4.ClH/c1-4-21-17(20)10-7-14-5-8-16(9-6-14)22-12-15(19)11-18-13(2)3;/h5-6,8-9,13,15,18-19H,4,7,10-12H2,1-3H3;1H

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 C17H27NO4
Molecular Weight 309.4006
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:37:46 GMT 2023
Edited
by admin
on Sat Dec 16 11:37:46 GMT 2023
Record UNII
2F57KC7ULB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACC-9129 HYDROCHLORIDE
Common Name English
BENZENEPROPANOIC ACID, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-, ETHYL ESTER, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
83356-58-5
Created by admin on Sat Dec 16 11:37:46 GMT 2023 , Edited by admin on Sat Dec 16 11:37:46 GMT 2023
PRIMARY
PUBCHEM
13040901
Created by admin on Sat Dec 16 11:37:46 GMT 2023 , Edited by admin on Sat Dec 16 11:37:46 GMT 2023
PRIMARY
FDA UNII
2F57KC7ULB
Created by admin on Sat Dec 16 11:37:46 GMT 2023 , Edited by admin on Sat Dec 16 11:37:46 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE