BUNOLOL HYDROCHLORIDE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C17H25NO3.ClH
Molecular Weight	327.846
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUNOLOL HYDROCHLORIDE

Structure Search

SMILES

Cl.CC(C)(C)NCC(O)COC1=CC=CC2=C1CCCC2=O

InChI

InChIKey=DNTDOBSIBZKFCP-UHFFFAOYSA-N

InChI=1S/C17H25NO3.ClH/c1-17(2,3)18-10-12(19)11-21-16-9-5-6-13-14(16)7-4-8-15(13)20;/h5-6,9,12,18-19H,4,7-8,10-11H2,1-3H3;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

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

Molecular Formula	C17H25NO3
Molecular Weight	291.3853
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 `Fri Dec 15 15:50:46 UTC 2023` Edited by `admin` on `Fri Dec 15 15:50:46 UTC 2023`
Record UNII	W0Q9J8634Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUNOLOL HYDROCHLORIDE

Official Name

English

BUNOLOL HYDROCHLORIDE [MART.]

Common Name

English

W 6412A

Code

English

W-6412A

Code

English

BUNOLOL HCL

Common Name

English

(±)-5-(3-(TERT-BUTYLAMINO)-2-HYDROXYPROPOXY)-3,4-DIHYDRO-1(2H)-NAPHTHALENONE HYDROCHLORIDE

Systematic Name

English

BUNOLOL HYDROCHLORIDE [USAN]

Common Name

English

1(2H)-NAPHTHALENONE, 5-(3-(1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-3,4-DIHYDRO-, HYDROCHLORIDE (±)-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29576

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

Code System Code Type Description

ChEMBL

CHEMBL293030

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

NCI_THESAURUS

C142972

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

EPA CompTox

DTXSID50953855

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

CAS

31969-05-8

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

PUBCHEM

34060

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

FDA UNII

W0Q9J8634Z

Created by admin on Fri Dec 15 15:50:46 UTC 2023 , Edited by admin on Fri Dec 15 15:50:46 UTC 2023

PRIMARY

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