Difloxacin hydrochloride trihydrate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H19F2N3O3.ClH.3H2O
Molecular Weight	489.897
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Difloxacin hydrochloride trihydrate

Structure Search

SMILES

O.O.O.Cl.CN1CCN(CC1)C2=C(F)C=C3C(=O)C(=CN(C4=CC=C(F)C=C4)C3=C2)C(O)=O

InChI

InChIKey=SQHQDGFUHKBUDY-UHFFFAOYSA-N

InChI=1S/C21H19F2N3O3.ClH.3H2O/c1-24-6-8-25(9-7-24)19-11-18-15(10-17(19)23)20(27)16(21(28)29)12-26(18)14-4-2-13(22)3-5-14;;;;/h2-5,10-12H,6-9H2,1H3,(H,28,29);1H;3*1H2

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C21H19F2N3O3
Molecular Weight	399.3907
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

Stereochemistry	ACHIRAL
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 19:48:30 UTC 2023` Edited by `admin` on `Sat Dec 16 19:48:30 UTC 2023`
Record UNII	CLS5XG8MST
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Difloxacin hydrochloride trihydrate

Common Name

English

3-Quinolinecarboxylic acid, 6-fluoro-1-(4-fluorophenyl)-1,4-dihydro-7-(4-methyl-1-piperazinyl)-4-oxo-, monohydrochloride, trihydrate

Systematic Name

English

DIFLOXACIN HYDROCHLORIDE TRIHYDRATE FOR VETERINARY USE

Common Name

English

3-Quinolinecarboxylic acid, 6-fluoro-1-(4-fluorophenyl)-1,4-dihydro-7-(4-methyl-1-piperazinyl)-4-oxo-, hydrochloride, hydrate (1:1:3)

Systematic Name

English

Code System Code Type Description

PUBCHEM

168429521

Created by admin on Sat Dec 16 19:48:31 UTC 2023 , Edited by admin on Sat Dec 16 19:48:31 UTC 2023

PRIMARY

FDA UNII

CLS5XG8MST

Created by admin on Sat Dec 16 19:48:31 UTC 2023 , Edited by admin on Sat Dec 16 19:48:31 UTC 2023

PRIMARY

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