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

Systemtic Name: [2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [2-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-(3-pyridylmethyl)ammonium CAS Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [2-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-(3-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=CN=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OCC2=C(C=C(C=C2)F)Cl)C[NH2+]CC3=CN=CC=C3

InChI

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