3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pentan-3-ylazanium

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pentan-3-ylazanium Openeye Name: [1-[(2-chloro-6-fluoro-phenyl)methyl]-1-ethyl-propyl]ammonium CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]pentan-3-ylammonium IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]pentan-3-ylazanium Traditional Name: [1-(2-chloro-6-fluoro-benzyl)-1-ethyl-propyl]ammonium Formula: C12H18ClFN+ MolecularWeight: 230.729423

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1=C(C=CC=C1Cl)F)[NH3+]

Isomeric SMILES

CCC(CC)(CC1=C(C=CC=C1Cl)F)[NH3+]

InChI

InChI=1S/C12H17ClFN/c1-3-12(15,4-2)8-9-10(13)6-5-7-11(9)14/h5-7H,3-4,8,15H2,1-2H3/p+1