MCN-2840-46

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H28N2O3.C4H4O4
Molecular Weight	436.4987
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of MCN-2840-46

Structure Search

SMILES

OC(=O)\C=C\C(O)=O.CCOC1=C(OCC)C=C(C=C1)C(CN=C2CCCN2C)OC

InChI

InChIKey=CLPGVGDRLLHAGS-WLHGVMLRSA-N

InChI=1S/C18H28N2O3.C4H4O4/c1-5-22-15-10-9-14(12-16(15)23-6-2)17(21-4)13-19-18-8-7-11-20(18)3;5-3(6)1-2-4(7)8/h9-10,12,17H,5-8,11,13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

Approval Year

Name

Type

Language

MCN-2840-46

Common Name

English

BENZENEETHANAMINE, 3,4-DIETHOXY-.BETA.-METHOXY-N-(1-METHYL-2-PYRROLIDINYLIDENE)-, (E)-2-BUTENEDIOATE (1:1)

Systematic Name

English

BENZENEETHANAMINE, 3,4-DIETHOXY-.BETA.-METHOXY-N-(1-METHYL-2-PYRROLIDINYLIDENE)-, (2E)-2-BUTENEDIOATE (1:1)

Systematic Name

English

2-((3,4-DIETHOXY-BETA-METHOXY-PHENETHYL)IMINO)-1-METHYL-PYRROLIDINE FUMARATE

Systematic Name

English

Code System Code Type Description

CAS

40665-49-4

Created by admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023

PRIMARY

FDA UNII

2LL9U9511R

Created by admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023

PRIMARY

PUBCHEM

91663263

Created by admin on Fri Dec 15 15:15:35 GMT 2023 , Edited by admin on Fri Dec 15 15:15:35 GMT 2023

PRIMARY

ACTIVE MOIETY


					6D791LCE7I

MCN-2840-46 FREE BASE

PARENT (SALT/SOLVATE)


					88XHZ13131

SUBSTANCE RECORD


					2LL9U9511R