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

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: [4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: benzyl-[4-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]ammonium Formula: C22H22ClFNO2+ MolecularWeight: 386.866983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=C2)OCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=C2)OCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C22H21ClFNO2/c1-26-22-11-17(14-25-13-16-5-3-2-4-6-16)7-10-21(22)27-15-18-8-9-19(24)12-20(18)23/h2-12,25H,13-15H2,1H3/p+1