N-Diethylamino oxycarbonyle-3 spirolactone chlorhydrate [French]

diethyl-[2-(8-methyl-7-oxo-6-oxaspiro[4.5]dec-8-ene-9-carbonyl)oxyethyl]azanium chloride

CAS: 85540-57-4

Molecular Formula	`C17H28ClNO4`
Molecular Weight	345.9 g/mol
Topological Polar Surface Area	57.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	7
Exact Mass	345.1707
Heavy Atoms	23
Complexity	459.0

Chemical Identifiers

CAS Number	85540-57-4
SMILES	`CC[NH+](CC)CCOC(=O)C1=C(C(=O)OC2(C1)CCCC2)C.[Cl-]`
InChIKey	`VYUVSTSLXWNFPS-UHFFFAOYSA-N`

📖 Product Overview

N-Diethylamino oxycarbonyle-3 spirolactone chlorhydrate [French] (CAS: 85540-57-4) is a chemical compound with molecular formula C17H28ClNO4 and molecular weight 345.9 g/mol. Its IUPAC systematic name is diethyl-[2-(8-methyl-7-oxo-6-oxaspiro[4.5]dec-8-ene-9-carbonyl)oxyethyl]azanium chloride. Topological Polar Surface Area 57.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 7 Exact Mass 345.1707 Heavy Atoms 23 Complexity 459.0 InChI Key: VYUVSTSLXWNFPS-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CCOC(=O)C1=C(C(=O)OC2(C1)CCCC2)C.[Cl-].

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