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Details

Stereochemistry ACHIRAL
Molecular Formula C18H13ClN2O7S2
Molecular Weight 468.888
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2-DIKETOSITAXENTAN

SMILES

CC1=NOC(NS(=O)(=O)C2=C(SC=C2)C(=O)C(=O)C3=C(C)C=C4OCOC4=C3)=C1Cl

InChI

InChIKey=DRTWGOOZUPWRNM-UHFFFAOYSA-N
InChI=1S/C18H13ClN2O7S2/c1-8-5-11-12(27-7-26-11)6-10(8)15(22)16(23)17-13(3-4-29-17)30(24,25)21-18-14(19)9(2)20-28-18/h3-6,21H,7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C18H13ClN2O7S2
Molecular Weight 468.888
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
G89962M5AF
Record Status Validated (UNII)
Record Version