[(2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,3-dimethoxy-propyl]azanium

Systemtic Name: [(2S)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,3-dimethoxy-propyl]azanium Openeye Name: [(2S)-2-[(2-chloro-6-fluoro-phenyl)methyl]-3,3-dimethoxy-propyl]ammonium CAS Name: [(2S)-2-[(2-chloro-6-fluorophenyl)methyl]-3,3-dimethoxypropyl]ammonium IUPAC Name: [(2S)-2-[(2-chloro-6-fluorophenyl)methyl]-3,3-dimethoxypropyl]azanium Traditional Name: [(2S)-2-(2-chloro-6-fluoro-benzyl)-3,3-dimethoxy-propyl]ammonium Formula: C12H18ClFNO2+ MolecularWeight: 262.728223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC([C@@H](CC1=C(C=CC=C1Cl)F)C[NH3+])OC

InChI

InChI=1S/C12H17ClFNO2/c1-16-12(17-2)8(7-15)6-9-10(13)4-3-5-11(9)14/h3-5,8,12H,6-7,15H2,1-2H3/p+1/t8-/m0/s1