[4-oxidanylidene-4-(2-propylpentanoyloxymethoxy)butyl]azanium chloride

Systemtic Name: [4-oxidanylidene-4-(2-propylpentanoyloxymethoxy)butyl]azanium chloride Openeye Name: [4-oxo-4-(2-propylpentanoyloxymethoxy)butyl]ammonium chloride CAS Name: [4-oxo-4-[(1-oxo-2-propylpentoxy)methoxy]butyl]ammonium chloride IUPAC Name: [4-oxo-4-(2-propylpentanoyloxymethoxy)butyl]azanium chloride Traditional Name: [4-keto-4-(2-propylpentanoyloxymethoxy)butyl]ammonium chloride Formula: C13H26ClNO4 MolecularWeight: 295.80284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)OCOC(=O)CCC[NH3+].[Cl-]

Isomeric SMILES

CCCC(CCC)C(=O)OCOC(=O)CCC[NH3+].[Cl-]

InChI

InChI=1S/C13H25NO4.ClH/c1-3-6-11(7-4-2)13(16)18-10-17-12(15)8-5-9-14;/h11H,3-10,14H2,1-2H3;1H