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

Systemtic Name: [2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]methyl-(2-methoxyethyl)azanium Openeye Name: [2-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-phenyl]methyl-(2-methoxyethyl)ammonium CAS Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl-(2-methoxyethyl)azanium Traditional Name: [2-(2-chloro-4-fluoro-benzyl)oxy-3-methoxy-benzyl]-(2-methoxyethyl)ammonium Formula: C18H22ClFNO3+ MolecularWeight: 354.823583

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

COCC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C18H21ClFNO3/c1-22-9-8-21-11-13-4-3-5-17(23-2)18(13)24-12-14-6-7-15(20)10-16(14)19/h3-7,10,21H,8-9,11-12H2,1-2H3/p+1