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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H19ClN2O3
Molecular Weight 286.755
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONOHYDROXYMELPHALAN

SMILES

N[C@@H](CC1=CC=C(C=C1)N(CCO)CCCl)C(O)=O

InChI

InChIKey=CPWJECQKVRUIOI-LBPRGKRZSA-N
InChI=1S/C13H19ClN2O3/c14-5-6-16(7-8-17)11-3-1-10(2-4-11)9-12(15)13(18)19/h1-4,12,17H,5-9,15H2,(H,18,19)/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H19ClN2O3
Molecular Weight 286.755
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

Approval Year

Substance Class Chemical
Record UNII
ESL4D945VL
Record Status Validated (UNII)
Record Version