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Details

Stereochemistry RACEMIC
Molecular Formula C15H23NO4
Molecular Weight 281.3474
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ESMOLOL ACID

SMILES

CC(C)NCC(O)COC1=CC=C(CCC(O)=O)C=C1

InChI

InChIKey=ILSCWPMGTDPATI-UHFFFAOYSA-N
InChI=1S/C15H23NO4/c1-11(2)16-9-13(17)10-20-14-6-3-12(4-7-14)5-8-15(18)19/h3-4,6-7,11,13,16-17H,5,8-10H2,1-2H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C15H23NO4
Molecular Weight 281.3474
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 07:09:57 UTC 2023
Edited
by admin
on Sat Dec 16 07:09:57 UTC 2023
Record UNII
G0SM48N856
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ESMOLOL ACID
Common Name English
ESMOLOL HYDROCHLORIDE IMPURITY, ESMOLOL FREE ACIDA- [USP IMPURITY]
Common Name English
ASL-8123
Code English
BENZENEPROPANOIC ACID, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-
Common Name English
(±)-ESMOLOL ACID
Common Name English
ESMOLOL FREE ACID [USP IMPURITY]
Common Name English
3-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)PROPIONIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80100180
Created by admin on Sat Dec 16 07:09:57 UTC 2023 , Edited by admin on Sat Dec 16 07:09:57 UTC 2023
PRIMARY
FDA UNII
G0SM48N856
Created by admin on Sat Dec 16 07:09:57 UTC 2023 , Edited by admin on Sat Dec 16 07:09:57 UTC 2023
PRIMARY
PUBCHEM
133620
Created by admin on Sat Dec 16 07:09:57 UTC 2023 , Edited by admin on Sat Dec 16 07:09:57 UTC 2023
PRIMARY
CAS
81148-15-4
Created by admin on Sat Dec 16 07:09:57 UTC 2023 , Edited by admin on Sat Dec 16 07:09:57 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP