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

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H38N2O7
Molecular Weight 526.6212
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MOEXIPRIL ETHYL ESTER

SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CC3=C(C[C@H]2C(=O)OCC)C=C(OC)C(OC)=C3

InChI

InChIKey=JCVOQMKUHSUGEJ-IGKWTDBASA-N
InChI=1S/C29H38N2O7/c1-6-37-28(33)23(14-13-20-11-9-8-10-12-20)30-19(3)27(32)31-18-22-17-26(36-5)25(35-4)16-21(22)15-24(31)29(34)38-7-2/h8-12,16-17,19,23-24,30H,6-7,13-15,18H2,1-5H3/t19-,23-,24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C29H38N2O7
Molecular Weight 526.6212
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:38:27 GMT 2023
Edited
by admin
on Sat Dec 16 18:38:27 GMT 2023
Record UNII
U4GE85GV7N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MOEXIPRIL ETHYL ESTER
Common Name English
ETHYL (3S)-2-((2S)-2-(((1S)-1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-3-ISOQUINOLINECARBOXYLATE
Systematic Name English
3-ISOQUINOLINECARBOXYLIC ACID, 2-(2-((1-(ETHOXYCARBONYL)-3-PHENYLPROPYL)AMINO)-1-OXOPROPYL)-1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, ETHYL ESTER, (3S-(2(R*(R*)),3R*))-
Systematic Name English
Code System Code Type Description
PUBCHEM
53948698
Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023
PRIMARY
FDA UNII
U4GE85GV7N
Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023
PRIMARY
CAS
103733-37-5
Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> DERIVATIVE