WV-761

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H22BrN3.C4H4O4
Molecular Weight	464.353
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CCN(C)CCN(CC1=CC=C(Br)C=C1)C2=CC=CC=N2

InChI

InChIKey=ZOAMODQUIVKJOU-BTJKTKAUSA-N

InChI=1S/C17H22BrN3.C4H4O4/c1-3-20(2)12-13-21(17-6-4-5-11-19-17)14-15-7-9-16(18)10-8-15;5-3(6)1-2-4(7)8/h4-11H,3,12-14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C17H22BrN3
Molecular Weight	348.281
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 01:28:55 GMT 2023` Edited by `admin` on `Sat Dec 16 01:28:55 GMT 2023`
Record UNII	P116Z5US4R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

WV-761

Common Name

English

1,2-ETHANEDIAMINE, N-((4-BROMOPHENYL)METHYL)-N'-ETHYL-N'-METHYL-N-2-PYRIDINYL-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

N-(P-BROMOBENZYL)-N-(.ALPHA.-PYRIDYL)-N'-METHYL-N'-ETHYLETHYLENEDIAMINE MALEATE

Common Name

English

Code System Code Type Description

PUBCHEM

6434149