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Details

Stereochemistry ACHIRAL
Molecular Formula C25H28N2O5
Molecular Weight 436.5002
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of KR-62980

SMILES

CCOC(=O)C1=C(C2=C(C=C(OCCN3CCOCC3)C=C2)\C1=[N+](\C)[O-])C4=CC=CC=C4

InChI

InChIKey=IPMKXUPPEBQHQL-SHHOIMCASA-N
InChI=1S/C25H28N2O5/c1-3-31-25(28)23-22(18-7-5-4-6-8-18)20-10-9-19(17-21(20)24(23)26(2)29)32-16-13-27-11-14-30-15-12-27/h4-10,17H,3,11-16H2,1-2H3/b26-24+

HIDE SMILES / InChI

Molecular Formula C25H28N2O5
Molecular Weight 436.5002
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:48:05 GMT 2025
Edited
by admin
on Mon Mar 31 22:48:05 GMT 2025
Record UNII
M3ZXT2A5FA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(TRANS-N-METHYL-N-OXOIMINO)-6-(2-(MORPHOLIN-4-YL)ETHOXY)-3-PHENYL-1H-INDENE-2-CARBOXYLIC ACID ETHYL ESTER
Preferred Name English
KR-62980
Code English
(1E)-2-(ETHOXYCARBONYL)-N-METHYL-6-(2-(MORPHOLIN-4-YL)ETHOXY)-N-OXIDO-3-PHENYL-1H-INDEN-1-IMINIUM
Systematic Name English
1H-INDENE-2-CARBOXYLIC ACID, 1-(METHYLOXIDOIMINO)-6-(2-(4-MORPHOLINYL)ETHOXY)-3-PHENYL-, ETHYL ESTER, (1E)-
Systematic Name English
KR62980
Code English
Code System Code Type Description
FDA UNII
M3ZXT2A5FA
Created by admin on Mon Mar 31 22:48:05 GMT 2025 , Edited by admin on Mon Mar 31 22:48:05 GMT 2025
PRIMARY
CAS
867187-61-9
Created by admin on Mon Mar 31 22:48:05 GMT 2025 , Edited by admin on Mon Mar 31 22:48:05 GMT 2025
PRIMARY
PUBCHEM
11546596
Created by admin on Mon Mar 31 22:48:05 GMT 2025 , Edited by admin on Mon Mar 31 22:48:05 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY