(2-chloranyl-6-fluoranyl-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium Openeye Name: (2-chloro-6-fluoro-phenyl)methyl-(2-hydroxyethyl)-propyl-ammonium CAS Name: (2-chloro-6-fluorophenyl)methyl-(2-hydroxyethyl)-propylammonium IUPAC Name: (2-chloro-6-fluorophenyl)methyl-(2-hydroxyethyl)-propylazanium Traditional Name: (2-chloro-6-fluoro-benzyl)-(2-hydroxyethyl)-propyl-ammonium Formula: C12H18ClFNO+ MolecularWeight: 246.728823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17ClFNO/c1-2-6-15(7-8-16)9-10-11(13)4-3-5-12(10)14/h3-5,16H,2,6-9H2,1H3/p+1