IRSENONTRINE MALEATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H22N4O3.C4H4O4
Molecular Weight	506.5072
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.COC1=C(C)C(=C(C)C=N1)C2=CC=C3C4=C(C=NN4[C@H]5CCOC5)C(=O)NC3=C2

InChI

InChIKey=AFKSGMDXSLTKSU-DASCVMRKSA-N

InChI=1S/C22H22N4O3.C4H4O4/c1-12-9-23-22(28-3)13(2)19(12)14-4-5-16-18(8-14)25-21(27)17-10-24-26(20(16)17)15-6-7-29-11-15;5-3(6)1-2-4(7)8/h4-5,8-10,15H,6-7,11H2,1-3H3,(H,25,27);1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m0./s1

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	C22H22N4O3
Molecular Weight	390.4351
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:51:55 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:55 GMT 2025`
Record UNII	VEF2IPK30K
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4H-PYRAZOLO(4,3-C)QUINOLIN-4-ONE, 1,5-DIHYDRO-7-(2-METHOXY-3,5-DIMETHYL-4-PYRIDINYL)-1-((3S)-TETRAHYDRO-3-FURANYL)-, (2Z)-2-BUTENEDIOATE (1:1)

Preferred Name

English

IRSENONTRINE MALEATE

Official Name

English

ER-000592221-MAL

Code

English

7-(2-METHOXY-3,5-DIMETHYLPYRIDIN-4-YL)-1-((3S)-TETRAHYDROFURAN-3-YL)-1,5-DIHYDRO-4H-PYRAZOLO(4,3-C)QUINOLIN-4-ONE MALEATE

Systematic Name

English

ER-592221-12

Code

English

IRSENONTRINE MALEATE [USAN]

Common Name

English

E-2027 MALEATE

Code

English

(S)-7-(2-METHOXY-3,5-DIMETHYLPYRIDIN-4-YL)-1-(TETRAHYDROFURAN-3-YL)-1,5-DIHYDRO-4H-PYRAZOLO(4,3-C)QUINOLIN-4-ONE MALEATE

Systematic Name

English

E2027 MALEATE

Code

English

Code System Code Type Description

USAN

HI-64