2-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylazaniumyl]ethyl-dimethyl-azanium dichloride

Systemtic Name: 2-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylazaniumyl]ethyl-dimethyl-azanium dichloride Openeye Name: 2-[[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]methylammonio]ethyl-dimethyl-ammonium dichloride CAS Name: 2-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylammonio]ethyl-dimethylammonium dichloride IUPAC Name: 2-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylazaniumyl]ethyl-dimethylazanium dichloride Traditional Name: 2-[[2-(2-fluorobenzyl)oxy-3-methoxy-benzyl]ammonio]ethyl-dimethyl-ammonium dichloride Formula: C19H27Cl2FN2O2 MolecularWeight: 405.334283

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=CC=C2F.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CC[NH2+]CC1=C(C(=CC=C1)OC)OCC2=CC=CC=C2F.[Cl-].[Cl-]

InChI

InChI=1S/C19H25FN2O2.2ClH/c1-22(2)12-11-21-13-15-8-6-10-18(23-3)19(15)24-14-16-7-4-5-9-17(16)20;;/h4-10,21H,11-14H2,1-3H3;2*1H