2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL) MORPHOLINE, (2R,3S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18F7NO2
Molecular Weight	437.3512
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL) MORPHOLINE, (2R,3S)-

Structure Search

SMILES

C[C@@H](O[C@H]1OCCN[C@H]1C2=CC=C(F)C=C2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChIKey=AFBDSAJOMZYQAI-CNOZUTPLSA-N

InChI=1S/C20H18F7NO2/c1-11(13-8-14(19(22,23)24)10-15(9-13)20(25,26)27)30-18-17(28-6-7-29-18)12-2-4-16(21)5-3-12/h2-5,8-11,17-18,28H,6-7H2,1H3/t11-,17+,18-/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

Title	Date	PubMed
A simple quantitative FT-IR approach for the study of a polymorphic transformation under crystallization slurry conditions.	2001 Jul	11377055

Patents

Name

Type

Language

2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL) MORPHOLINE, (2R,3S)-

Common Name

English

MORPHOLINE, 2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL)-, (2R,3S)-

Systematic Name

English

Code System Code Type Description

CAS

171338-27-5

Created by admin on Sat Dec 16 11:23:58 GMT 2023 , Edited by admin on Sat Dec 16 11:23:58 GMT 2023

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FDA UNII

EA5SX368WV

Created by admin on Sat Dec 16 11:23:58 GMT 2023 , Edited by admin on Sat Dec 16 11:23:58 GMT 2023

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EPA CompTox

DTXSID00435818

Created by admin on Sat Dec 16 11:23:58 GMT 2023 , Edited by admin on Sat Dec 16 11:23:58 GMT 2023

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PUBCHEM

10113945

Created by admin on Sat Dec 16 11:23:58 GMT 2023 , Edited by admin on Sat Dec 16 11:23:58 GMT 2023

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PARENT (METABOLITE)


					1NF15YR6UY

APREPITANT

SUBSTANCE RECORD


					EA5SX368WV

2-((1R)-1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)ETHOXY)-3-(4-FLUOROPHENYL) MORPHOLINE, (2R,3S)-