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Details

Stereochemistry ACHIRAL
Molecular Formula C17H13ClN2O4S
Molecular Weight 376.814
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PIGMENT RED 53 ACID

SMILES

CC1=C(Cl)C=C(C(=C1)\N=N\C2=C(O)C=CC3=CC=CC=C23)S(O)(=O)=O

InChI

InChIKey=IYHIFXGFKVJNBB-FMQUCBEESA-N
InChI=1S/C17H13ClN2O4S/c1-10-8-14(16(9-13(10)18)25(22,23)24)19-20-17-12-5-3-2-4-11(12)6-7-15(17)21/h2-9,21H,1H3,(H,22,23,24)/b20-19+

HIDE SMILES / InChI

Molecular Formula C17H13ClN2O4S
Molecular Weight 376.814
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
V5JEX3KGDA
Record Status Validated (UNII)
Record Version