(3,5-dimethyl-4-oxidanyl-phenyl)methyl-[2-(4-fluorophenyl)ethyl]azanium

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl-[2-(4-fluorophenyl)ethyl]azanium Openeye Name: 2-(4-fluorophenyl)ethyl-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]ammonium CAS Name: 2-(4-fluorophenyl)ethyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]ammonium IUPAC Name: 2-(4-fluorophenyl)ethyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]azanium Traditional Name: 2-(4-fluorophenyl)ethyl-(4-hydroxy-3,5-dimethyl-benzyl)ammonium Formula: C17H21FNO+ MolecularWeight: 274.353143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]CCC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+]CCC2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FNO/c1-12-9-15(10-13(2)17(12)20)11-19-8-7-14-3-5-16(18)6-4-14/h3-6,9-10,19-20H,7-8,11H2,1-2H3/p+1