BTS-67582

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H20N4O.C4H4O4
Molecular Weight	364.3963
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.CN(C)C(=N)NC1=C(C=CC=C1)N2CCOCC2

InChI

InChIKey=FFEKJBVVAJTQST-WLHGVMLRSA-N

InChI=1S/C13H20N4O.C4H4O4/c1-16(2)13(14)15-11-5-3-4-6-12(11)17-7-9-18-10-8-17;5-3(6)1-2-4(7)8/h3-6H,7-10H2,1-2H3,(H2,14,15);1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

Molecular Formula	C13H20N4O
Molecular Weight	248.3241
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:53:51 UTC 2023` Edited by `admin` on `Fri Dec 15 15:53:51 UTC 2023`
Record UNII	C83HW55OVT
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BTS-67582

Common Name

English

GUANIDINE, N,N-DIMETHYL-N'-(2-(4-MORPHOLINYL)PHENYL)-, (E)-2-BUTENEDIOATE (1:1)

Systematic Name

English

1,1-DIMETHYL-2-(2-(4-MORPHOLINOPHENYL))GUANIDINE MONOFUMARATE

Common Name

English

GUANIDINE, N,N-DIMETHYL-N'-(2-(4-MORPHOLINYL)PHENYL)-, (2E)-2-BUTENEDIOATE (1:1)

Systematic Name

English

BTS-67-582

Code

English

Code System Code Type Description

PUBCHEM

9885406

Created by admin on Fri Dec 15 15:53:51 UTC 2023 , Edited by admin on Fri Dec 15 15:53:51 UTC 2023

PRIMARY

FDA UNII

C83HW55OVT

Created by admin on Fri Dec 15 15:53:51 UTC 2023 , Edited by admin on Fri Dec 15 15:53:51 UTC 2023

PRIMARY

CAS

161748-40-9

Created by admin on Fri Dec 15 15:53:51 UTC 2023 , Edited by admin on Fri Dec 15 15:53:51 UTC 2023

PRIMARY

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