(1RS)-1-((DIMETHYLAMINO)METHYL)-1-PHENYLPROPYL 3,4,5-TRIMETHOXYBENZOATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C22H29NO5
Molecular Weight	387.4694
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (1RS)-1-((DIMETHYLAMINO)METHYL)-1-PHENYLPROPYL 3,4,5-TRIMETHOXYBENZOATE

Structure Search

SMILES

CCC(CN(C)C)(OC(=O)C1=CC(OC)=C(OC)C(OC)=C1)C2=CC=CC=C2

InChI

InChIKey=SICYQWJKPPIMGO-UHFFFAOYSA-N

InChI=1S/C22H29NO5/c1-7-22(15-23(2)3,17-11-9-8-10-12-17)28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5/h8-14H,7,15H2,1-6H3

HIDE SMILES / InChI

Molecular Formula	C22H29NO5
Molecular Weight	387.4694
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 15:04:55 UTC 2023` Edited by `admin` on `Sat Dec 16 15:04:55 UTC 2023`
Record UNII	XKX4ZZ0DJC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(1RS)-1-((DIMETHYLAMINO)METHYL)-1-PHENYLPROPYL 3,4,5-TRIMETHOXYBENZOATE

Systematic Name

English

BENZOIC ACID, 3,4,5-TRIMETHOXY-, 1-((DIMETHYLAMINO)METHYL)-1-PHENYLPROPYL ESTER

Systematic Name

English

TRIMEBUTINE MALEATE IMPURITY D [EP IMPURITY]

Common Name

English

1-DIMETHYLAMINO-2-PHENYLBUTAN-2-YL 3,4,5-TRIMETHOXYBENZOATE

Systematic Name

English

Code System Code Type Description

FDA UNII

XKX4ZZ0DJC

Created by admin on Sat Dec 16 15:04:55 UTC 2023 , Edited by admin on Sat Dec 16 15:04:55 UTC 2023

PRIMARY

PUBCHEM

129318537

Created by admin on Sat Dec 16 15:04:55 UTC 2023 , Edited by admin on Sat Dec 16 15:04:55 UTC 2023

PRIMARY

CAS

92414-09-0

Created by admin on Sat Dec 16 15:04:55 UTC 2023 , Edited by admin on Sat Dec 16 15:04:55 UTC 2023

PRIMARY

Related Record Type Details


					2A051GM4YM

TRIMEBUTINE MALEATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: