ESMOLOL HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C16H25NO4.ClH
Molecular Weight	331.835
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

Cl.COC(=O)CCC1=CC=C(OCC(O)CNC(C)C)C=C1

InChI

InChIKey=GEKNCWBANDDJJL-UHFFFAOYSA-N

InChI=1S/C16H25NO4.ClH/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3;/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula	C16H25NO4
Molecular Weight	295.374
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

Substance Class	Chemical
Record UNII	V05260LC8D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ESMOLOL HYDROCHLORIDE

Official Name

English

ASL-8052

Code

English

ESMOLOL HYDROCHLORIDE [HSDB]

Common Name

English

BENZENEPROPANOIC ACID, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-, METHYL ESTER, HYDROCHLORIDE (1:1)

Systematic Name

English

ESMOLOL HCL

Common Name

English

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Classification Tree

Code System

Code

Adrenergic Antagonist

NCI_THESAURUS

C29576

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Code System

Code

Type

Description

RS_ITEM_NUM

1249701

PRIMARY

NCI_THESAURUS

C47519

PRIMARY

DRUG BANK

DBSALT000586

PRIMARY

HSDB

6530

PRIMARY

RXCUI

203222

PRIMARY

RxNorm

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ESMOLOL HYDROCHLORIDE, (S)-

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ESMOLOL HYDROCHLORIDE

BASIS OF STRENGTH->SUBSTANCE

Comments:

NLT 98.0% and NMT 102.0% of C16H25NO4?HCl, calculated on the anhydrous basis

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

RELATIONSHIP_AMOUNT [98 to 102] WEIGHT PERCENT (limits)

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Methyl 3-{4-[3-(ethylamino)-2-hydroxypropoxy]phenyl}propionate

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

RELATIONSHIP_AMOUNT [<0.15] PERCENT PEAK AREA (limits)


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METHYL 3-(4-(5-AMINO-2-HYDROXYPENTYLOXY)PHENYL)PROPANOATE

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

RELATIONSHIP_AMOUNT [<0.1] PERCENT PEAK AREA (limits)


					G0SM48N856

ESMOLOL ACID

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

RELATIONSHIP_AMOUNT [<0.3] PERCENT PEAK AREA (limits)


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ESMOLOL DIMER

IMPURITY -> PARENT

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount:

RELATIONSHIP_AMOUNT [<0.15] PERCENT PEAK AREA (limits)

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