Compound C17H31Cl2N3O

2-(diethylazaniumyl)ethyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium dichloride

CAS: 77966-81-5

Molecular Formula	`C17H31Cl2N3O`
Molecular Weight	364.4 g/mol
Topological Polar Surface Area	38.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	363.18442
Heavy Atoms	23
Complexity	294.0

Chemical Identifiers

CAS Number	77966-81-5
SMILES	`CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC=C1C)C.[Cl-].[Cl-]`
InChIKey	`AGCRUJJXPAKCSA-UHFFFAOYSA-N`

📖 Product Overview

Compound C17H31Cl2N3O (CAS: 77966-81-5) is a chemical compound with molecular formula C17H31Cl2N3O and molecular weight 364.4 g/mol. Its IUPAC systematic name is 2-(diethylazaniumyl)ethyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium dichloride. Topological Polar Surface Area 38.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 363.18442 Heavy Atoms 23 Complexity 294.0 InChI Key: AGCRUJJXPAKCSA-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CC[NH+](C)CC(=O)NC1=C(C=CC=C1C)C.[Cl-].[Cl-].

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