diethyl-[2-[4-(3-methylbutanoyl)phenoxy]ethyl]azanium chloride

Systemtic Name: diethyl-[2-[4-(3-methylbutanoyl)phenoxy]ethyl]azanium chloride Openeye Name: diethyl-[2-[4-(3-methylbutanoyl)phenoxy]ethyl]ammonium chloride CAS Name: diethyl-[2-[4-(3-methyl-1-oxobutyl)phenoxy]ethyl]ammonium chloride IUPAC Name: diethyl-[2-[4-(3-methylbutanoyl)phenoxy]ethyl]azanium chloride Traditional Name: diethyl-[2-(4-isovalerylphenoxy)ethyl]ammonium chloride Formula: C17H28ClNO2 MolecularWeight: 313.86272

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=C(C=C1)C(=O)CC(C)C.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=C(C=C1)C(=O)CC(C)C.[Cl-]

InChI

InChI=1S/C17H27NO2.ClH/c1-5-18(6-2)11-12-20-16-9-7-15(8-10-16)17(19)13-14(3)4;/h7-10,14H,5-6,11-13H2,1-4H3;1H