Paliperidone N-Oxide

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H27FN4O4
Molecular Weight	442.4833
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=C(CC[N+]2([O-])CCC(CC2)C3=NOC4=C3C=CC(F)=C4)C(=O)N5CCCC(O)C5=N1

InChI

InChIKey=SOGHBNZGNKDZHD-UHFFFAOYSA-N

InChI=1S/C23H27FN4O4/c1-14-17(23(30)27-9-2-3-19(29)22(27)25-14)8-12-28(31)10-6-15(7-11-28)21-18-5-4-16(24)13-20(18)32-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3

HIDE SMILES / InChI

Molecular Formula	C23H27FN4O4
Molecular Weight	442.4833
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 13:46:10 GMT 2025` Edited by `admin` on `Wed Apr 02 13:46:10 GMT 2025`
Record UNII	PN34M47VMX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Paliperidone N-Oxide

Common Name

English

3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-oxido-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one

Preferred Name

English

4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-oxido-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-

Systematic Name

English

Code System Code Type Description

PUBCHEM

24782992

Created by admin on Wed Apr 02 13:46:10 GMT 2025 , Edited by admin on Wed Apr 02 13:46:10 GMT 2025

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EPA CompTox

DTXSID30647306

Created by admin on Wed Apr 02 13:46:10 GMT 2025 , Edited by admin on Wed Apr 02 13:46:10 GMT 2025

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FDA UNII

PN34M47VMX

Created by admin on Wed Apr 02 13:46:10 GMT 2025 , Edited by admin on Wed Apr 02 13:46:10 GMT 2025

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CAS

761460-08-6

Created by admin on Wed Apr 02 13:46:10 GMT 2025 , Edited by admin on Wed Apr 02 13:46:10 GMT 2025

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