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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17Cl2NO.ClH
Molecular Weight 358.69
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DICLOFENSINE HYDROCHLORIDE, (R)-

SMILES

Cl.COC1=CC=C2[C@H](CN(C)CC2=C1)C3=CC(Cl)=C(Cl)C=C3

InChI

InChIKey=PEHOXCSPLOXNOK-XFULWGLBSA-N
InChI=1S/C17H17Cl2NO.ClH/c1-20-9-12-7-13(21-2)4-5-14(12)15(10-20)11-3-6-16(18)17(19)8-11;/h3-8,15H,9-10H2,1-2H3;1H/t15-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C17H17Cl2NO
Molecular Weight 322.229
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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
6PY9VW69JR
Record Status Validated (UNII)
Record Version