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

Systemtic Name: [2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(pyridin-2-ylmethyl)azanium Openeye Name: [2-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-(2-pyridylmethyl)ammonium CAS Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(2-pyridinylmethyl)ammonium IUPAC Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(pyridin-2-ylmethyl)azanium Traditional Name: [2-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-(2-pyridylmethyl)ammonium Formula: C21H21ClFN2O2+ MolecularWeight: 387.855043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=C(C=C(C=C2)F)Cl)C[NH2+]CC3=CC=CC=N3

Isomeric SMILES

COC1=CC=CC(=C1OCC2=C(C=C(C=C2)F)Cl)C[NH2+]CC3=CC=CC=N3

InChI

InChI=1S/C21H20ClFN2O2/c1-26-20-7-4-5-15(12-24-13-18-6-2-3-10-25-18)21(20)27-14-16-8-9-17(23)11-19(16)22/h2-11,24H,12-14H2,1H3/p+1