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Details

Stereochemistry ACHIRAL
Molecular Formula C15H7F7NO3.Na
Molecular Weight 405.1996
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NELONEMDAZ SODIUM

SMILES

[Na+].OC1=C(C=C(NCC2=C(F)C(F)=C(C(F)=C2F)C(F)(F)F)C=C1)C([O-])=O

InChI

InChIKey=JRUKCFQBEJZBGU-UHFFFAOYSA-M
InChI=1S/C15H8F7NO3.Na/c16-10-7(11(17)13(19)9(12(10)18)15(20,21)22)4-23-5-1-2-8(24)6(3-5)14(25)26;/h1-3,23-24H,4H2,(H,25,26);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C15H7F7NO3
Molecular Weight 382.2098
Charge -1
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 Na
Molecular Weight 22.98976928
Charge 1
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

PubMed

Substance Class Chemical
Record UNII
MMY7F8FR6C
Record Status Validated (UNII)
Record Version