Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-, monohydrochloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H37Cl3N4O4.ClH
Molecular Weight	708.502
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-, monohydrochloride

Structure Search

SMILES

Cl.CCC(C)(C)C1=CC=C(OCC(=O)NC2=CC(=CC=C2)C(=O)NC3=NN(C(=O)C3)C4=C(Cl)C=C(Cl)C=C4Cl)C(=C1)C(C)(C)CC

InChI

InChIKey=WEJHFWWVWMMSQI-UHFFFAOYSA-N

InChI=1S/C34H37Cl3N4O4.ClH/c1-7-33(3,4)21-12-13-27(24(15-21)34(5,6)8-2)45-19-29(42)38-23-11-9-10-20(14-23)32(44)39-28-18-30(43)41(40-28)31-25(36)16-22(35)17-26(31)37;/h9-17H,7-8,18-19H2,1-6H3,(H,38,42)(H,39,40,44);1H

HIDE SMILES / InChI

Molecular Formula	C34H37Cl3N4O4
Molecular Weight	672.041
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:08:44 GMT 2023` Edited by `admin` on `Sat Dec 16 12:08:44 GMT 2023`
Record UNII	L2L7VZV64E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzamide, 3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-, monohydrochloride

Systematic Name

English

Benzamide, 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-, hydrochloride (1:1)

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

264-031-3