BUTOFILOLOL MALEATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C17H26FNO3.C4H4O4
Molecular Weight	427.4638
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CCCC(=O)C1=C(OCC(O)CNC(C)(C)C)C=CC(F)=C1

InChI

InChIKey=XAFHIGHFTQNWCF-BTJKTKAUSA-N

InChI=1S/C17H26FNO3.C4H4O4/c1-5-6-15(21)14-9-12(18)7-8-16(14)22-11-13(20)10-19-17(2,3)4;5-3(6)1-2-4(7)8/h7-9,13,19-20H,5-6,10-11H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

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	C17H26FNO3
Molecular Weight	311.3916
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 10:00:24 GMT 2023` Edited by `admin` on `Sat Dec 16 10:00:24 GMT 2023`
Record UNII	5O9KI0VYPM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BUTOFILOLOL MALEATE

Common Name

English

CAFIDE

Brand Name

English

BUTOFILOLOL MALEATE [MI]

Common Name

English

1-(2-(3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-5-FLUOROPHENYL)-1-BUTANONE, MALEATE

Systematic Name

English

1-BUTANONE, 1-(2-(3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-5-FLUOROPHENYL)-, (2Z)-2-BUTENEDIOATE (1:1) (SALT)

Systematic Name

English

Code System Code Type Description

MERCK INDEX

m607

Created by admin on Sat Dec 16 10:00:24 GMT 2023 , Edited by admin on Sat Dec 16 10:00:24 GMT 2023

PRIMARY

Merck Index

PUBCHEM

6450493

Created by admin on Sat Dec 16 10:00:24 GMT 2023 , Edited by admin on Sat Dec 16 10:00:24 GMT 2023

PRIMARY

FDA UNII

5O9KI0VYPM

Created by admin on Sat Dec 16 10:00:24 GMT 2023 , Edited by admin on Sat Dec 16 10:00:24 GMT 2023

PRIMARY

CAS

88606-96-6

Created by admin on Sat Dec 16 10:00:24 GMT 2023 , Edited by admin on Sat Dec 16 10:00:24 GMT 2023

PRIMARY

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