[4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]methyl-(3-methylbutyl)azanium

Systemtic Name: [4-[bis(fluoranyl)methoxy]-3-ethoxy-phenyl]methyl-(3-methylbutyl)azanium Openeye Name: [4-(difluoromethoxy)-3-ethoxy-phenyl]methyl-isopentyl-ammonium CAS Name: [4-(difluoromethoxy)-3-ethoxyphenyl]methyl-(3-methylbutyl)ammonium IUPAC Name: [4-(difluoromethoxy)-3-ethoxyphenyl]methyl-(3-methylbutyl)azanium Traditional Name: [4-(difluoromethoxy)-3-ethoxy-benzyl]-isoamyl-ammonium Formula: C15H24F2NO2+ MolecularWeight: 288.353366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCC(C)C)OC(F)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCC(C)C)OC(F)F

InChI

InChI=1S/C15H23F2NO2/c1-4-19-14-9-12(10-18-8-7-11(2)3)5-6-13(14)20-15(16)17/h5-6,9,11,15,18H,4,7-8,10H2,1-3H3/p+1