[5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [5-(azaniumylmethyl)-2-fluoranyl-phenyl]methyl-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [5-(azaniumylmethyl)-2-fluoro-phenyl]methyl-methyl-(p-tolylmethyl)ammonium CAS Name: [5-(ammoniomethyl)-2-fluorophenyl]methyl-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [5-(azaniumylmethyl)-2-fluorophenyl]methyl-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [5-(ammoniomethyl)-2-fluoro-benzyl]-methyl-(4-methylbenzyl)ammonium Formula: C17H23FN2+2 MolecularWeight: 274.376323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CC2=C(C=CC(=C2)C[NH3+])F

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CC2=C(C=CC(=C2)C[NH3+])F

InChI

InChI=1S/C17H21FN2/c1-13-3-5-14(6-4-13)11-20(2)12-16-9-15(10-19)7-8-17(16)18/h3-9H,10-12,19H2,1-2H3/p+2