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

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 METHYL 3-(4-(5-AMINO-2-HYDROXYPENTYLOXY)PHENYL)PROPANOATE

SMILES

COC(=O)CCC1=CC=C(OCC(O)CCCN)C=C1

InChI

InChIKey=YTILJMPMEJUPSO-UHFFFAOYSA-N
InChI=1S/C15H23NO4/c1-19-15(18)9-6-12-4-7-14(8-5-12)20-11-13(17)3-2-10-16/h4-5,7-8,13,17H,2-3,6,9-11,16H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
METHYL 3-(4-(5-AMINO-2-HYDROXYPENTYLOXY)PHENYL)PROPANOATE
Systematic Name English
ESMOLOL AMINOPENTANOL ANALOG [USP IMPURITY]
Common Name English
ESMOLOL HYDROCHLORIDE IMPURITY, ESMOLOL AMINOPENTANOL ANALOG- [USP IMPURITY]
Common Name English
(±)-METHYL 3-(4-(5-AMINO-2-HYDROXYPENTYLOXY)PHENYL)PROPANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
RA2NR3LOB4
Created by admin on Sat Dec 16 07:09:58 GMT 2023 , Edited by admin on Sat Dec 16 07:09:58 GMT 2023
PRIMARY
PUBCHEM
139033149
Created by admin on Sat Dec 16 07:09:58 GMT 2023 , Edited by admin on Sat Dec 16 07:09:58 GMT 2023
PRIMARY
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966