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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H10NO.Na
Molecular Weight 207.2037
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 3-ANILINOPHENOXIDE

SMILES

[Na+].[O-]C1=CC=CC(NC2=CC=CC=C2)=C1

InChI

InChIKey=BTTHZSRZNOXUBQ-UHFFFAOYSA-M
InChI=1S/C12H11NO.Na/c14-12-8-4-7-11(9-12)13-10-5-2-1-3-6-10;/h1-9,13-14H;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C12H10NO
Molecular Weight 184.2139
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
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 Fri Dec 15 17:34:40 GMT 2023
Edited
by admin
on Fri Dec 15 17:34:40 GMT 2023
Record UNII
9O9D5W2G35
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 3-ANILINOPHENOXIDE
Systematic Name English
PHENOL, 3-(PHENYLAMINO)-, MONOSODIUM SALT
Systematic Name English
PHENOL, 3-(PHENYLAMINO)-, SODIUM SALT (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
91864466
Created by admin on Fri Dec 15 17:34:40 GMT 2023 , Edited by admin on Fri Dec 15 17:34:40 GMT 2023
PRIMARY
FDA UNII
9O9D5W2G35
Created by admin on Fri Dec 15 17:34:40 GMT 2023 , Edited by admin on Fri Dec 15 17:34:40 GMT 2023
PRIMARY
CAS
84950-65-2
Created by admin on Fri Dec 15 17:34:40 GMT 2023 , Edited by admin on Fri Dec 15 17:34:40 GMT 2023
PRIMARY