N-[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl]heptanamide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H34N2O4
Molecular Weight	390.5164
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl]heptanamide

Structure Search

SMILES

CCCCCCC(=O)N[C@H](CN1CCCC1)[C@H](O)C2=CC=C3OCCOC3=C2

InChI

InChIKey=NPUUFEABNQXZQW-XMSQKQJNSA-N

InChI=1S/C22H34N2O4/c1-2-3-4-5-8-21(25)23-18(16-24-11-6-7-12-24)22(26)17-9-10-19-20(15-17)28-14-13-27-19/h9-10,15,18,22,26H,2-8,11-14,16H2,1H3,(H,23,25)/t18-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H34N2O4
Molecular Weight	390.5164
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:46:22 GMT 2025` Edited by `admin` on `Wed Apr 02 18:46:22 GMT 2025`
Record UNII	R4ME7Z8TJL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Eliglustat impurity A

Preferred Name

English

N-[(1R,2R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-hydroxy-3-(pyrrolidin-1-yl)propan-2-yl]heptanamide

Systematic Name

English

N-[(1R,2R)-2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(1-pyrrolidinylmethyl)ethyl]heptanamide

Systematic Name

English

Heptanamide, N-[(1R,2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-1-(1-pyrrolidinylmethyl)ethyl]-

Systematic Name

English

Code System Code Type Description

CAS

2193052-00-3

Created by admin on Wed Apr 02 18:46:22 GMT 2025 , Edited by admin on Wed Apr 02 18:46:22 GMT 2025

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FDA UNII

R4ME7Z8TJL

Created by admin on Wed Apr 02 18:46:22 GMT 2025 , Edited by admin on Wed Apr 02 18:46:22 GMT 2025

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PUBCHEM

165429062

Created by admin on Wed Apr 02 18:46:22 GMT 2025 , Edited by admin on Wed Apr 02 18:46:22 GMT 2025

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