FURETHIDINE PICRATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H31NO4.C6H3N3O7
Molecular Weight	590.5791
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=C(C=C(C=C1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O.CCOC(=O)C2(CCN(CCOCC3CCCO3)CC2)C4=CC=CC=C4

InChI

InChIKey=YDSZNPQSJASIFZ-UHFFFAOYSA-N

InChI=1S/C21H31NO4.C6H3N3O7/c1-2-25-20(23)21(18-7-4-3-5-8-18)10-12-22(13-11-21)14-16-24-17-19-9-6-15-26-19;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-5,7-8,19H,2,6,9-17H2,1H3;1-2,10H

HIDE SMILES / InChI

Molecular Formula	C21H31NO4
Molecular Weight	361.4751
Charge	0
Count

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

Molecular Formula	C6H3N3O7
Molecular Weight	229.1039
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 11:08:13 GMT 2023` Edited by `admin` on `Sat Dec 16 11:08:13 GMT 2023`
Record UNII	5MLE50YVZN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FURETHIDINE PICRATE

Common Name

English

PICRATE FURETHIDINE

Common Name

English

4-PIPERIDINECARBOXYLIC ACID, 4-PHENYL-1-(2-((TETRAHYDRO-2-FURANYL)METHOXY)ETHYL)-, ETHYL ESTER, COMPD. WITH 2,4,6-TRINITROPHENOL (1:1)

Systematic Name

English

ISONIPECOTIC ACID, 4-PHENYL-1-(2-(TETRAHYDROFURFURYLOXY)ETHYL)-, ETHYL ESTER, PICRATE

Common Name

English

Code System Code Type Description

CAS

103163-66-2

Created by admin on Sat Dec 16 11:08:13 GMT 2023 , Edited by admin on Sat Dec 16 11:08:13 GMT 2023

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PUBCHEM

126961360

Created by admin on Sat Dec 16 11:08:13 GMT 2023 , Edited by admin on Sat Dec 16 11:08:13 GMT 2023

PRIMARY

FDA UNII

5MLE50YVZN

Created by admin on Sat Dec 16 11:08:13 GMT 2023 , Edited by admin on Sat Dec 16 11:08:13 GMT 2023

PRIMARY

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FURETHIDINE

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