N-Dimethylaminopropyl oxycarbonyle-3 spirolactone chlorhydrate [French]

dimethyl-[3-(8-methyl-7-oxo-6-oxaspiro[4.5]dec-8-ene-9-carbonyl)oxypropyl]azanium chloride

CAS: 85540-58-5

Molecular Formula	`C16H26ClNO4`
Molecular Weight	331.8 g/mol
Topological Polar Surface Area	57.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	331.15503
Heavy Atoms	22
Complexity	447.0

Chemical Identifiers

CAS Number	85540-58-5
SMILES	`CC1=C(CC2(CCCC2)OC1=O)C(=O)OCCC[NH+](C)C.[Cl-]`
InChIKey	`GGSUOOJXTGGMFL-UHFFFAOYSA-N`

📖 Product Overview

N-Dimethylaminopropyl oxycarbonyle-3 spirolactone chlorhydrate [French] (CAS: 85540-58-5) is a chemical compound with molecular formula C16H26ClNO4 and molecular weight 331.8 g/mol. Its IUPAC systematic name is dimethyl-[3-(8-methyl-7-oxo-6-oxaspiro[4.5]dec-8-ene-9-carbonyl)oxypropyl]azanium chloride. Topological Polar Surface Area 57.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 331.15503 Heavy Atoms 22 Complexity 447.0 InChI Key: GGSUOOJXTGGMFL-UHFFFAOYSA-N. SMILES: CC1=C(CC2(CCCC2)OC1=O)C(=O)OCCC[NH+](C)C.[Cl-].

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