2-(4-methoxyphenyl)-4,6-dithiophen-2-yl-1,3,5-oxadiazin-1-ium tetrafluoroborate

Systemtic Name: 2-(4-methoxyphenyl)-4,6-dithiophen-2-yl-1,3,5-oxadiazin-1-ium tetrafluoroborate Openeye Name: 2-(4-methoxyphenyl)-4,6-bis(2-thienyl)-1,3,5-oxadiazin-1-ium tetrafluoroborate CAS Name: 2-(4-methoxyphenyl)-4,6-dithiophen-2-yl-1,3,5-oxadiazin-1-ium tetrafluoroborate IUPAC Name: 2-(4-methoxyphenyl)-4,6-dithiophen-2-yl-1,3,5-oxadiazin-1-ium tetrafluoroborate Traditional Name: 2-(4-methoxyphenyl)-4,6-bis(2-thienyl)-1,3,5-oxadiazin-1-ium tetrafluoroborate Formula: C18H13BF4N2O2S2 MolecularWeight: 440.242633

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=CC=C(C=C1)C2=[O+]C(=NC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

[B-](F)(F)(F)F.COC1=CC=C(C=C1)C2=[O+]C(=NC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C18H13N2O2S2.BF4/c1-21-13-8-6-12(7-9-13)17-19-16(14-4-2-10-23-14)20-18(22-17)15-5-3-11-24-15;2-1(3,4)5/h2-11H,1H3;/q+1;-1