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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H19NO4
Molecular Weight 265.305
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL (S)-((3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1(6),2,4-TRIEN-7-YL)METHYL)(METHYL)CARBAMATE

SMILES

CCOC(=O)NC[C@H]1CC2=CC(OC)=C(OC)C=C12

InChI

InChIKey=GJIGBWPQLXKDIU-SNVBAGLBSA-N
InChI=1S/C14H19NO4/c1-4-19-14(16)15-8-10-5-9-6-12(17-2)13(18-3)7-11(9)10/h6-7,10H,4-5,8H2,1-3H3,(H,15,16)/t10-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
ETHYL (S)-((3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1(6),2,4-TRIEN-7-YL)METHYL)(METHYL)CARBAMATE
Systematic Name English
CARBAMIC ACID, N-(((7S)-3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)METHYL)-, ETHYL ESTER
Systematic Name English
ETHYL (((7S)-3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)METHYL)CARBAMATE
Common Name English
IVABRADINE IMPURITY 9
Common Name English
Code System Code Type Description
FDA UNII
PDJ3NQ9FH6
Created by admin on Sat Dec 16 18:41:45 GMT 2023 , Edited by admin on Sat Dec 16 18:41:45 GMT 2023
PRIMARY
CAS
869856-10-0
Created by admin on Sat Dec 16 18:41:45 GMT 2023 , Edited by admin on Sat Dec 16 18:41:45 GMT 2023
PRIMARY
EPA CompTox
DTXSID901134510
Created by admin on Sat Dec 16 18:41:45 GMT 2023 , Edited by admin on Sat Dec 16 18:41:45 GMT 2023
PRIMARY
PUBCHEM
23590135
Created by admin on Sat Dec 16 18:41:45 GMT 2023 , Edited by admin on Sat Dec 16 18:41:45 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