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Details

Stereochemistry ACHIRAL
Molecular Formula C35H40F2N6O3
Molecular Weight 630.7286
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3-(2-(4-((Z)-(4-FLUORO-2-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PIPERIDIN-1-YL)PHENYL)(HYDROXYIMINO)METHYL)PIPERIDIN-1-YL)ETHYL)-2-METHYL-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE

SMILES

Cc1c(CCN2CCC(CC2)/C(=N/O)/c3ccc(cc3N4CCC(CC4)c5c6ccc(cc6on5)F)F)c(=O)n7CCCCc7n1

InChI

InChIKey=GQIQUGILXGRQGO-SCURRHDHSA-N
InChI=1S/C35H40F2N6O3/c1-22-27(35(44)43-14-3-2-4-32(43)38-22)13-17-41-15-9-23(10-16-41)33(39-45)28-7-5-25(36)20-30(28)42-18-11-24(12-19-42)34-29-8-6-26(37)21-31(29)46-40-34/h5-8,20-21,23-24,45H,2-4,9-19H2,1H3/b39-33-

HIDE SMILES / InChI

Molecular Formula C35H40F2N6O3
Molecular Weight 630.7286
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 12:32:07 UTC 2021
Edited
by admin
on Sat Jun 26 12:32:07 UTC 2021
Record UNII
I88Q63DM73
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(2-(4-((Z)-(4-FLUORO-2-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)PIPERIDIN-1-YL)PHENYL)(HYDROXYIMINO)METHYL)PIPERIDIN-1-YL)ETHYL)-2-METHYL-6,7,8,9-TETRAHYDRO-4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE
Systematic Name English
4H-PYRIDO(1,2-A)PYRIMIDIN-4-ONE, 3-(2-(4-((4-FLUORO-2-(4-(6-FLUORO-1,2-BENZISOXAZOL-3-YL)-1-PIPERIDINYL)PHENYL)(HYDROXYIMINO)METHYL)-1-PIPERIDINYL)ETHYL)-6,7,8,9-TETRAHYDRO-2-METHYL-
Systematic Name English
RISPERIDONE IMPURITY J [EP]
Common Name English
Code System Code Type Description
PUBCHEM
72942023
Created by admin on Sat Jun 26 12:32:07 UTC 2021 , Edited by admin on Sat Jun 26 12:32:07 UTC 2021
PRIMARY
CAS
1346606-24-3
Created by admin on Sat Jun 26 12:32:07 UTC 2021 , Edited by admin on Sat Jun 26 12:32:07 UTC 2021
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
I88Q63DM73
Created by admin on Sat Jun 26 12:32:07 UTC 2021 , Edited by admin on Sat Jun 26 12:32:07 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
UNSPECIFIED
EP