3,6-BIS(N-FUMARYL-N-(BUTYL)AMINO)-2,5-DIKETOPIPERAZINE

Details

Stereochemistry	MIXED
Molecular Formula	C20H28N4O8
Molecular Weight	452.4583
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 3,6-BIS(N-FUMARYL-N-(BUTYL)AMINO)-2,5-DIKETOPIPERAZINE

Structure Search

SMILES

OC(=O)\C=C\C(=O)NCCCCC1NC(=O)C(CCCCNC(=O)\C=C\C(O)=O)NC1=O

InChI

InChIKey=BBNKIRVUCQNAQR-FIFLTTCUSA-N

InChI=1S/C20H28N4O8/c25-15(7-9-17(27)28)21-11-3-1-5-13-19(31)24-14(20(32)23-13)6-2-4-12-22-16(26)8-10-18(29)30/h7-10,13-14H,1-6,11-12H2,(H,21,25)(H,22,26)(H,23,32)(H,24,31)(H,27,28)(H,29,30)/b9-7+,10-8+

HIDE SMILES / InChI

Molecular Formula	C20H28N4O8
Molecular Weight	452.4583
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:22:33 GMT 2023` Edited by `admin` on `Sat Dec 16 15:22:33 GMT 2023`
Record UNII	VEE1PFG4U6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3,6-BIS(N-FUMARYL-N-(BUTYL)AMINO)-2,5-DIKETOPIPERAZINE

Common Name

English

(2E,2'E)-4,4'-((3,6-DIOXO-2,5-PIPERAZINEDIYL)BIS(4,1-BUTANEDIYLIMINO))BIS(4-OXO-2-BUTENOIC ACID)

Systematic Name

English

2-BUTENOIC ACID, 4,4'-((3,6-DIOXO-2,5-PIPERAZINEDIYL)BIS(4,1-BUTANEDIYLIMINO))BIS(4-OXO-, (2E,2'E)-

Systematic Name

English

4,4'-((3,6-DIOXO-2,5-PIPERAZINEDIYL)BIS(4,1-BUTANEDIYLIMINO)BIS(4-OXO)-2-BUTENOIC ACID, 2A(E),5A(E)

Systematic Name

English

TECHNOSPHERE COMPONENT FDKP

Common Name

English

Code System Code Type Description

PUBCHEM

9890069

Created by admin on Sat Dec 16 15:22:33 GMT 2023 , Edited by admin on Sat Dec 16 15:22:33 GMT 2023

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CAS

294659-59-9

Created by admin on Sat Dec 16 15:22:33 GMT 2023 , Edited by admin on Sat Dec 16 15:22:33 GMT 2023

PRIMARY

FDA UNII

VEE1PFG4U6

Created by admin on Sat Dec 16 15:22:33 GMT 2023 , Edited by admin on Sat Dec 16 15:22:33 GMT 2023

PRIMARY

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FUMARYL DIKETOPIPERAZINE

ENANTIOMER->MIXED