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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14N4O2.Cl.Na
Molecular Weight 256.665
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-CARBOXMETHYLMETHENAMINE SODIUM CHLORIDE

SMILES

[Na+].[Cl-].[O-]C(=O)C[N+]12CN3CN(CN(C3)C1)C2

InChI

InChIKey=ATQJGCFVXMQAFH-UHFFFAOYSA-M
InChI=1S/C8H14N4O2.ClH.Na/c13-8(14)1-12-5-9-2-10(6-12)4-11(3-9)7-12;;/h1-7H2;1H;/q;;+1/p-1

HIDE SMILES / InChI

Molecular Formula C8H14N4O2
Molecular Weight 198.2224
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
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

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
N9PVB1QCLF
Record Status Validated (UNII)
Record Version