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Details

Stereochemistry ACHIRAL
Molecular Formula C18H13ClNO2.Na
Molecular Weight 333.744
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-, monosodium salt

SMILES

[Na+].CC1=CC=C(Cl)C=C1NC(=O)C2=C([O-])C=C3C=CC=CC3=C2

InChI

InChIKey=HKHIARHWWVRGON-UHFFFAOYSA-M
InChI=1S/C18H14ClNO2.Na/c1-11-6-7-14(19)10-16(11)20-18(22)15-8-12-4-2-3-5-13(12)9-17(15)21;/h2-10,21H,1H3,(H,20,22);/q;+1/p-1

HIDE SMILES / InChI

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

Molecular Formula C18H13ClNO2
Molecular Weight 310.754
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 12:52:20 GMT 2023
Edited
by admin
on Sat Dec 16 12:52:20 GMT 2023
Record UNII
TG2ME45QZ9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-, monosodium salt
Common Name English
2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-, sodium salt
Common Name English
2-Naphthalenecarboxamide, N-(5-chloro-2-methylphenyl)-3-hydroxy-, sodium salt (1:1)
Systematic Name English
Code System Code Type Description
CAS
68540-87-4
Created by admin on Sat Dec 16 12:52:20 GMT 2023 , Edited by admin on Sat Dec 16 12:52:20 GMT 2023
PRIMARY
PUBCHEM
23668709
Created by admin on Sat Dec 16 12:52:20 GMT 2023 , Edited by admin on Sat Dec 16 12:52:20 GMT 2023
PRIMARY
FDA UNII
TG2ME45QZ9
Created by admin on Sat Dec 16 12:52:20 GMT 2023 , Edited by admin on Sat Dec 16 12:52:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
271-322-9
Created by admin on Sat Dec 16 12:52:20 GMT 2023 , Edited by admin on Sat Dec 16 12:52:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID9071632
Created by admin on Sat Dec 16 12:52:20 GMT 2023 , Edited by admin on Sat Dec 16 12:52:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE