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Details

Stereochemistry ACHIRAL
Molecular Formula C22H29Cl2N9O
Molecular Weight 506.431
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OXOCHLORHEXIDINE

SMILES

ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=O)NC2=CC=C(Cl)C=C2)C=C1

InChI

InChIKey=MEUUWVFEOGQPTR-UHFFFAOYSA-N
InChI=1S/C22H29Cl2N9O/c23-15-5-9-17(10-6-15)30-21(27)32-19(25)28-13-3-1-2-4-14-29-20(26)33-22(34)31-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,28,30,32)(H4,26,29,31,33,34)

HIDE SMILES / InChI

Molecular Formula C22H29Cl2N9O
Molecular Weight 506.431
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
5MR06Z2V1L
Record Status Validated (UNII)
Record Version