BIA-3-335

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H20F3N3O5.2ClH
Molecular Weight	512.307
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.Cl.OC1=CC(=CC(=C1O)[N+]([O-])=O)C(=O)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChIKey=FWUNZJWHTRFWKD-UHFFFAOYSA-N

InChI=1S/C20H20F3N3O5.2ClH/c21-20(22,23)14-2-1-3-15(12-14)25-8-6-24(7-9-25)5-4-17(27)13-10-16(26(30)31)19(29)18(28)11-13;;/h1-3,10-12,28-29H,4-9H2;2*1H

HIDE SMILES / InChI

Approval Year

Name

Type

Language

BIA-3-335

Common Name

English

1-PROPANONE, 1-(3,4-DIHYDROXY-5-NITROPHENYL)-3-(4-(3-(TRIFLUOROMETHYL)PHENYL)-1-PIPERAZINYL)-, HYDROCHLORIDE (1:2)

Systematic Name

English

1-PROPANONE, 1-(3,4-DIHYDROXY-5-NITROPHENYL)-3-(4-(3-(TRIFLUOROMETHYL)PHENYL)-1-PIPERAZINYL)-, DIHYDROCHLORIDE

Systematic Name

English

1-(3,4-DIHYDROXY-5-NITROPHENYL)-3-(4-(3-TRIFLUOROMETHYLPHENYL)PIPERAZIN-1-YL)PROPAN-1-ONE DIHYDROCHLORIDE

Systematic Name

English

Code System Code Type Description

FDA UNII

4M39AXR39C

Created by admin on Sat Dec 16 09:27:32 UTC 2023 , Edited by admin on Sat Dec 16 09:27:32 UTC 2023

PRIMARY

CAS

359783-06-5

Created by admin on Sat Dec 16 09:27:32 UTC 2023 , Edited by admin on Sat Dec 16 09:27:32 UTC 2023

PRIMARY

PUBCHEM

10301218

Created by admin on Sat Dec 16 09:27:32 UTC 2023 , Edited by admin on Sat Dec 16 09:27:32 UTC 2023

PRIMARY

ACTIVE MOIETY


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BIA-3-335