3-HYDROXYFLUNITRAZEPAM

Details

Stereochemistry	UNKNOWN
Molecular Formula	C16H12FN3O4
Molecular Weight	329.2826
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1C2=C(C=C(C=C2)[N+]([O-])=O)C(=NC(O)C1=O)C3=C(F)C=CC=C3

InChI

InChIKey=KJTUBZKMFRILQD-UHFFFAOYSA-N

InChI=1S/C16H12FN3O4/c1-19-13-7-6-9(20(23)24)8-11(13)14(18-15(21)16(19)22)10-4-2-3-5-12(10)17/h2-8,15,21H,1H3

HIDE SMILES / InChI

Molecular Formula	C16H12FN3O4
Molecular Weight	329.2826
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:34:58 UTC 2023` Edited by `admin` on `Sat Dec 16 15:34:58 UTC 2023`
Record UNII	KZ7TC72WAA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-HYDROXYFLUNITRAZEPAM

Common Name

English

2H-1,4-BENZODIAZEPIN-2-ONE, 5-(2-FLUOROPHENYL)-1,3-DIHYDRO-3-HYDROXY-1-METHYL-7-NITRO-

Systematic Name

English

5-(2-FLUOROPHENYL)-1,3-DIHYDRO-3-HYDROXY-1-METHYL-7-NITRO-2H-1,4-BENZODIAZEPIN-2-ONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90987073

Created by admin on Sat Dec 16 15:34:58 UTC 2023 , Edited by admin on Sat Dec 16 15:34:58 UTC 2023

PRIMARY

CAS

67739-71-3

Created by admin on Sat Dec 16 15:34:58 UTC 2023 , Edited by admin on Sat Dec 16 15:34:58 UTC 2023

PRIMARY

FDA UNII

KZ7TC72WAA

Created by admin on Sat Dec 16 15:34:58 UTC 2023 , Edited by admin on Sat Dec 16 15:34:58 UTC 2023

PRIMARY

PUBCHEM

128908

Created by admin on Sat Dec 16 15:34:58 UTC 2023 , Edited by admin on Sat Dec 16 15:34:58 UTC 2023

PRIMARY

Related Record Type Details


					620X0222FQ

FLUNITRAZEPAM

PARENT -> METABOLITE ACTIVE

Interaction Type:

MAJOR

Amount: