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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14NO2.Na
Molecular Weight 275.2776
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of OKY-1581

SMILES

[Na+].C\C(=C/C1=CC=C(CC2=CC=CN=C2)C=C1)C([O-])=O

InChI

InChIKey=ZAPOSLLMEZKFQS-NBYYMMLRSA-M
InChI=1S/C16H15NO2.Na/c1-12(16(18)19)9-13-4-6-14(7-5-13)10-15-3-2-8-17-11-15;/h2-9,11H,10H2,1H3,(H,18,19);/q;+1/p-1/b12-9+;

HIDE SMILES / InChI

Molecular Formula C16H14NO2
Molecular Weight 252.2879
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:31:48 GMT 2023
Edited
by admin
on Sat Dec 16 10:31:48 GMT 2023
Record UNII
Z5E7R0J67C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OKY-1581
Common Name English
2-PROPENOIC ACID, 2-METHYL-3-(4-(3-PYRIDINYLMETHYL)PHENYL)-, SODIUM SALT (1:1), (2E)-
Systematic Name English
ONO-1581
Code English
Code System Code Type Description
PUBCHEM
23663937
Created by admin on Sat Dec 16 10:31:48 GMT 2023 , Edited by admin on Sat Dec 16 10:31:48 GMT 2023
PRIMARY
FDA UNII
Z5E7R0J67C
Created by admin on Sat Dec 16 10:31:48 GMT 2023 , Edited by admin on Sat Dec 16 10:31:48 GMT 2023
PRIMARY
CAS
75987-18-7
Created by admin on Sat Dec 16 10:31:48 GMT 2023 , Edited by admin on Sat Dec 16 10:31:48 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY