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

Details

Stereochemistry ACHIRAL
Molecular Formula C20H18N3.Br
Molecular Weight 380.281
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIMIDIUM BROMIDE

SMILES

[Br-].C[N+]1=C(C2=CC=CC=C2)C3=C(C=CC(N)=C3)C4=CC=C(N)C=C14

InChI

InChIKey=MQOKYEROIFEEBH-UHFFFAOYSA-N
InChI=1S/C20H17N3.BrH/c1-23-19-12-15(22)8-10-17(19)16-9-7-14(21)11-18(16)20(23)13-5-3-2-4-6-13;/h2-12,22H,21H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula BrH
Molecular Weight 80.912
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H17N3
Molecular Weight 299.3691
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 Fri Dec 15 19:40:44 GMT 2023
Edited
by admin
on Fri Dec 15 19:40:44 GMT 2023
Record UNII
4LYH37ZZQ2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIMIDIUM BROMIDE
Common Name English
TRYPADINE
Common Name English
2,7-DIAMINO-10-METHYL-9-PHENYLPHENANTHRIDINIUM BROMIDE
Systematic Name English
NSC-522842
Code English
PHENANTHRIDINIUM, 3,8-DIAMINO-5-METHYL-6-PHENYL-, BROMIDE (1:1)
Systematic Name English
PHENANTHRIDINIUM COMPOUND 1553
Common Name English
PHENANTHRIDINIUM, 3,8-DIAMINO-5-METHYL-6-PHENYL-, BROMIDE
Systematic Name English
3,8-DIAMINO-5-METHYL-6-PHENYLPHENANTHRIDINIUM BROMIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30966125
Created by admin on Fri Dec 15 19:40:44 GMT 2023 , Edited by admin on Fri Dec 15 19:40:44 GMT 2023
PRIMARY
FDA UNII
4LYH37ZZQ2
Created by admin on Fri Dec 15 19:40:44 GMT 2023 , Edited by admin on Fri Dec 15 19:40:44 GMT 2023
PRIMARY
CAS
518-67-2
Created by admin on Fri Dec 15 19:40:44 GMT 2023 , Edited by admin on Fri Dec 15 19:40:44 GMT 2023
PRIMARY
NSC
522842
Created by admin on Fri Dec 15 19:40:44 GMT 2023 , Edited by admin on Fri Dec 15 19:40:44 GMT 2023
PRIMARY
PUBCHEM
68207
Created by admin on Fri Dec 15 19:40:44 GMT 2023 , Edited by admin on Fri Dec 15 19:40:44 GMT 2023
PRIMARY