(2-chloranyl-6-fluoranyl-phenyl)methyl-(3-phenylpropyl)azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-(3-phenylpropyl)azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-(3-phenylpropyl)ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-(3-phenylpropyl)ammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-(3-phenylpropyl)azanium Traditional Name: (2-chloro-6-fluoro-benzyl)-(3-phenylpropyl)ammonium Formula: C16H18ClFN+ MolecularWeight: 278.772223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC[NH2+]CC2=C(C=CC=C2Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CCC[NH2+]CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H17ClFN/c17-15-9-4-10-16(18)14(15)12-19-11-5-8-13-6-2-1-3-7-13/h1-4,6-7,9-10,19H,5,8,11-12H2/p+1