[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-phenethyl-azanium

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-phenethyl-azanium Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-phenethyl-ammonium CAS Name: [4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-phenethylammonium IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-phenethylazanium Traditional Name: [4-(2-chloro-6-fluoro-benzyl)oxy-3-methoxy-benzyl]-phenethyl-ammonium Formula: C23H24ClFNO2+ MolecularWeight: 400.893563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCC2=CC=CC=C2)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCC2=CC=CC=C2)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H23ClFNO2/c1-27-23-14-18(15-26-13-12-17-6-3-2-4-7-17)10-11-22(23)28-16-19-20(24)8-5-9-21(19)25/h2-11,14,26H,12-13,15-16H2,1H3/p+1