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Details

Stereochemistry ACHIRAL
Molecular Formula C27H22Cl2N4.HNO3
Molecular Weight 536.409
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Clofazimine nitrate

SMILES

O[N+]([O-])=O.CC(C)\N=C1/C=C2N(C3=CC=C(Cl)C=C3)C4=C(C=CC=C4)N=C2C=C1NC5=CC=C(Cl)C=C5

InChI

InChIKey=CHLWFJFIAMAKJH-WTKGSRSZSA-N
InChI=1S/C27H22Cl2N4.HNO3/c1-17(2)30-24-16-27-25(15-23(24)31-20-11-7-18(28)8-12-20)32-22-5-3-4-6-26(22)33(27)21-13-9-19(29)10-14-21;2-1(3)4/h3-17,31H,1-2H3;(H,2,3,4)/b30-24+;

HIDE SMILES / InChI

Molecular Formula HNO3
Molecular Weight 63.0128
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

Molecular Formula C27H22Cl2N4
Molecular Weight 473.396
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
64E63Q3QCS
Record Status Validated (UNII)
Record Version