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Details

Stereochemistry ACHIRAL
Molecular Formula C31H39N3O4
Molecular Weight 517.6591
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRAZPIROBEN

SMILES

OC(=O)C1=CC=CC(CN2CN(C3CCCCC3)C4(CCN(CCCC(=O)C5=CC=CC=C5)CC4)C2=O)=C1

InChI

InChIKey=BDXJYAAYLZTLEK-UHFFFAOYSA-N
InChI=1S/C31H39N3O4/c35-28(25-10-3-1-4-11-25)15-8-18-32-19-16-31(17-20-32)30(38)33(23-34(31)27-13-5-2-6-14-27)22-24-9-7-12-26(21-24)29(36)37/h1,3-4,7,9-12,21,27H,2,5-6,8,13-20,22-23H2,(H,36,37)

HIDE SMILES / InChI

Molecular Formula C31H39N3O4
Molecular Weight 517.6591
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
FH87H57Q4Y
Record Status Validated (UNII)
Record Version