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Details

Stereochemistry MIXED
Molecular Formula C32H26Cl2N6O4
Molecular Weight 629.493
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of BENZIDINE YELLOW

SMILES

CC(=O)C(\N=N\C1=CC=C(C=C1Cl)C2=CC(Cl)=C(C=C2)\N=N\C(C(C)=O)C(=O)NC3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChIKey=GNCOVOVCHIHPHP-HVMBLDELSA-N
InChI=1S/C32H26Cl2N6O4/c1-19(41)29(31(43)35-23-9-5-3-6-10-23)39-37-27-15-13-21(17-25(27)33)22-14-16-28(26(34)18-22)38-40-30(20(2)42)32(44)36-24-11-7-4-8-12-24/h3-18,29-30H,1-2H3,(H,35,43)(H,36,44)/b39-37+,40-38+

HIDE SMILES / InChI

Molecular Formula C32H26Cl2N6O4
Molecular Weight 629.493
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
N52TUS5TRY
Record Status Validated (UNII)
Record Version