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Details

Stereochemistry ACHIRAL
Molecular Formula C26H26N5O.Cl
Molecular Weight 459.971
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of JANUS RED

SMILES

[Cl-].CC1=CC(=CC=C1\N=N\C2=CC(=CC=C2)[N+](C)(C)C)\N=N\C3=C4C=CC=CC4=CC=C3O

InChI

InChIKey=HGWOEPQHKBLMKW-UHFFFAOYSA-N
InChI=1S/C26H25N5O.ClH/c1-18-16-21(28-30-26-23-11-6-5-8-19(23)12-15-25(26)32)13-14-24(18)29-27-20-9-7-10-22(17-20)31(2,3)4;/h5-17H,1-4H3;1H

HIDE SMILES / InChI

Molecular Formula C26H25N5O
Molecular Weight 423.5096
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 2
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
URC5KZU6QB
Record Status Validated (UNII)
Record Version