Benzamide, 4-((chloroacetyl)amino)-N-(2-(diethylamino)ethyl)-, ethanedioate (1:1)

2-[[4-[(2-chloroacetyl)amino]benzoyl]amino]ethyl-diethylazanium;2-hydroxy-2-oxoacetate

CAS: 104816-29-7

Molecular Formula	`C17H24ClN3O6`
Molecular Weight	401.8 g/mol
Topological Polar Surface Area	140.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	401.13538
Heavy Atoms	27
Complexity	405.0

Chemical Identifiers

CAS Number	104816-29-7
SMILES	`CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CCl.C(=O)(C(=O)[O-])O`
InChIKey	`MOUWFHYXDXUHEX-UHFFFAOYSA-N`

📖 Product Overview

Benzamide, 4-((chloroacetyl)amino)-N-(2-(diethylamino)ethyl)-, ethanedioate (1:1) (CAS: 104816-29-7) is a chemical compound with molecular formula C17H24ClN3O6 and molecular weight 401.8 g/mol. Its IUPAC systematic name is 2-[[4-[(2-chloroacetyl)amino]benzoyl]amino]ethyl-diethylazanium;2-hydroxy-2-oxoacetate. Topological Polar Surface Area 140.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 6 Rotatable Bonds 8 Exact Mass 401.13538 Heavy Atoms 27 Complexity 405.0 InChI Key: MOUWFHYXDXUHEX-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CCl.C(=O)(C(=O)[O-])O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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