4-methoxy-2-methyl-1-phenethyl-3-phenylmethoxy-pyridin-1-ium tetrafluoroborate

Systemtic Name: 4-methoxy-2-methyl-1-phenethyl-3-phenylmethoxy-pyridin-1-ium tetrafluoroborate Openeye Name: 3-benzyloxy-4-methoxy-2-methyl-1-phenethyl-pyridin-1-ium tetrafluoroborate CAS Name: 4-methoxy-2-methyl-1-phenethyl-3-phenylmethoxypyridin-1-ium tetrafluoroborate IUPAC Name: 4-methoxy-2-methyl-1-phenethyl-3-phenylmethoxypyridin-1-ium tetrafluoroborate Traditional Name: 3-benzoxy-4-methoxy-2-methyl-1-phenethyl-pyridin-1-ium tetrafluoroborate Formula: C22H24BF4NO2 MolecularWeight: 421.236073

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=[N+](C=CC(=C1OCC2=CC=CC=C2)OC)CCC3=CC=CC=C3

Isomeric SMILES

[B-](F)(F)(F)F.CC1=[N+](C=CC(=C1OCC2=CC=CC=C2)OC)CCC3=CC=CC=C3

InChI

InChI=1S/C22H24NO2.BF4/c1-18-22(25-17-20-11-7-4-8-12-20)21(24-2)14-16-23(18)15-13-19-9-5-3-6-10-19;2-1(3,4)5/h3-12,14,16H,13,15,17H2,1-2H3;/q+1;-1