OCAROCOXIB TROMETHAMINE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H6F6O4.C4H11NO3
Molecular Weight	449.2991
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OCAROCOXIB TROMETHAMINE

Structure Search

SMILES

NC(CO)(CO)CO.OC(=O)C1=CC2=C(OC1C(F)(F)F)C=CC(OC(F)(F)F)=C2

InChI

InChIKey=MWZUJRVBVVSULF-UHFFFAOYSA-N

InChI=1S/C12H6F6O4.C4H11NO3/c13-11(14,15)9-7(10(19)20)4-5-3-6(22-12(16,17)18)1-2-8(5)21-9;5-4(1-6,2-7)3-8/h1-4,9H,(H,19,20);6-8H,1-3,5H2

HIDE SMILES / InChI

Approval Year

Name

Type

Language

OCAROCOXIB TROMETHAMINE

Official Name

English

OCAROCOXIB TROMETHAMINE [USAN]

Preferred Name

English

(2RS)-6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)-2H-CHROMENE-3-CARBOXYLIC ACID, (1:1) SALT WITH 2-AMINO-2-(HYDROXYMETHYL)PROPANE-1,3-DIOL

Systematic Name

English

2H-1-BENZOPYRAN-3-CARBOXYLIC ACID, 6-(TRIFLUOROMETHOXY)-2-(TRIFLUOROMETHYL)-, COMPD. WITH 2-AMINO-2-(HYDROXYMETHYL)-1,3-PROPANEDIOL (1:1)

Systematic Name

English

Code System Code Type Description

CAS

2279971-28-5

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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PUBCHEM

154702464

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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SMS_ID

300000028915

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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NCI_THESAURUS

C177078

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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FDA UNII

BMR39WX395

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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USAN

GH-139

Created by admin on Wed Apr 02 09:52:44 GMT 2025 , Edited by admin on Wed Apr 02 09:52:44 GMT 2025

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ACTIVE MOIETY


					96RH6Z678D

SUBSTANCE RECORD


					BMR39WX395

OCAROCOXIB TROMETHAMINE