RALOXIFENE N-OXIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H27NO5S
Molecular Weight	489.583
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=CC=C(C=C1)C2=C(C(=O)C3=CC=C(OCC[N+]4([O-])CCCCC4)C=C3)C5=CC=C(O)C=C5S2

InChI

InChIKey=KNADIZJVEMEXLS-UHFFFAOYSA-N

InChI=1S/C28H27NO5S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)35-28)27(32)19-6-11-23(12-7-19)34-17-16-29(33)14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2

HIDE SMILES / InChI

Molecular Formula	C28H27NO5S
Molecular Weight	489.583
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 07:56:02 UTC 2023` Edited by `admin` on `Sat Dec 16 07:56:02 UTC 2023`
Record UNII	X1BRV5W297
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RALOXIFENE N-OXIDE

Common Name

English

RALOXIFENE RELATED COMPOUND C

Common Name

English

RALOXIFENE RELATED COMPOUND C [USP-RS]

Common Name

English

RALOXIFENE HYDROCHLORIDE IMPURITY C [EP IMPURITY]

Common Name

English

(6-HYDROXY-2-(4-HYDROXYPHENYL)-1-BENZOTHIOPHEN-3-YL)(4-(2-(PIPERIDIN-1-YL)ETHOXY)PHENYL)METHANONE N-OXIDE

Systematic Name

English

RALOXIFENE RELATED COMPOUND C [USP IMPURITY]

Common Name

English

METHANONE, (6-HYDROXY-2-(4-HYDROXYPHENYL)BENZO(B)THIEN-3-YL)(4-(2-(1-OXIDO-1-PIPERIDINYL)ETHOXY)PHENYL)-

Systematic Name

English

Code System Code Type Description

CAS

195454-31-0