2-[4-(Diethylamino)-2-methylbenzoyl]benzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H21NO3
Molecular Weight	311.3749
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-[4-(Diethylamino)-2-methylbenzoyl]benzoic acid

Structure Search

SMILES

CCN(CC)C1=CC=C(C(=O)C2=CC=CC=C2C(O)=O)C(C)=C1

InChI

InChIKey=IZHHSJHVOYVIRH-UHFFFAOYSA-N

InChI=1S/C19H21NO3/c1-4-20(5-2)14-10-11-15(13(3)12-14)18(21)16-8-6-7-9-17(16)19(22)23/h6-12H,4-5H2,1-3H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula	C19H21NO3
Molecular Weight	311.3749
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:59:50 GMT 2023` Edited by `admin` on `Sat Dec 16 11:59:50 GMT 2023`
Record UNII	WLZ5HRB8R3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-[4-(Diethylamino)-2-methylbenzoyl]benzoic acid

Systematic Name

English

Benzoic acid, 2-[4-(diethylamino)-2-methylbenzoyl]-

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

258-210-5

Created by admin on Sat Dec 16 11:59:50 GMT 2023 , Edited by admin on Sat Dec 16 11:59:50 GMT 2023

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CAS

52830-65-6

Created by admin on Sat Dec 16 11:59:50 GMT 2023 , Edited by admin on Sat Dec 16 11:59:50 GMT 2023

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PUBCHEM

104335

Created by admin on Sat Dec 16 11:59:50 GMT 2023 , Edited by admin on Sat Dec 16 11:59:50 GMT 2023

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EPA CompTox

DTXSID5068811

Created by admin on Sat Dec 16 11:59:50 GMT 2023 , Edited by admin on Sat Dec 16 11:59:50 GMT 2023

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FDA UNII

WLZ5HRB8R3

Created by admin on Sat Dec 16 11:59:50 GMT 2023 , Edited by admin on Sat Dec 16 11:59:50 GMT 2023

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