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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H18N3O4.Cl
Molecular Weight 363.796
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CELESTINE BLUE

SMILES

[Cl-].CCN(CC)C1=CC=C2N=C3C(=CC(O)=C(O)C3=[O+]C2=C1)C(N)=O

InChI

InChIKey=VXAFJUDTZSMEFN-UHFFFAOYSA-N
InChI=1S/C17H17N3O4.ClH/c1-3-20(4-2)9-5-6-11-13(7-9)24-16-14(19-11)10(17(18)23)8-12(21)15(16)22;/h5-8H,3-4H2,1-2H3,(H3-,18,19,21,22,23);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C17H17N3O4
Molecular Weight 327.3346
Charge 0
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 04:02:32 GMT 2023
Edited
by admin
on Sat Dec 16 04:02:32 GMT 2023
Record UNII
T83565QF0P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CELESTINE BLUE
Common Name English
CELESTIN BLUE [MI]
Common Name English
C.I. MORDANT BLUE 14
Code English
1-CARBAMOYL-7-(DIETHYLAMINO)-3,4-DIHYDROXYPHENAZOXONIUM CHLORIDE
Common Name English
PHENOXAZIN-5-IUM, 1PHENOXAZIN-5-IUM, 1-(AMINOCARBONYL)-7-(DIETHYLAMINO)-3,4-DIHYDROXY-, CHLORIDE
Common Name English
C.I. 51050
Code English
MICHROME NO. 66.
Code English
COREIN 2R
Brand Name English
NSC-7823
Code English
COREINE BLUE B
Common Name English
1-(AMINOCARBONYL)-7-(DIETHYLAMINO)-3,4-DIHYDROXYPHENOXAZIN-5-IUM CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
216-346-2
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY
FDA UNII
T83565QF0P
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY
MERCK INDEX
m3231
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY Merck Index
NSC
7823
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID70935390
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY
CAS
1562-90-9
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY
CHEBI
88183
Created by admin on Sat Dec 16 04:02:32 GMT 2023 , Edited by admin on Sat Dec 16 04:02:32 GMT 2023
PRIMARY