2-(6-butoxynaphthalen-2-yl)-6-methyl-thieno[2,3-c]pyridin-6-ium tetrafluoroborate

Systemtic Name: 2-(6-butoxynaphthalen-2-yl)-6-methyl-thieno[2,3-c]pyridin-6-ium tetrafluoroborate Openeye Name: 2-(6-butoxy-2-naphthyl)-6-methyl-thieno[2,3-c]pyridin-6-ium tetrafluoroborate CAS Name: 2-(6-butoxy-2-naphthalenyl)-6-methylthieno[2,3-c]pyridin-6-ium tetrafluoroborate IUPAC Name: 2-(6-butoxynaphthalen-2-yl)-6-methylthieno[2,3-c]pyridin-6-ium tetrafluoroborate Traditional Name: 2-(6-butoxy-2-naphthyl)-6-methyl-thieno[2,3-c]pyridin-6-ium tetrafluoroborate Formula: C22H22BF4NOS MolecularWeight: 435.285793

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(S3)C=[N+](C=C4)C

Isomeric SMILES

[B-](F)(F)(F)F.CCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(S3)C=[N+](C=C4)C

InChI

InChI=1S/C22H22NOS.BF4/c1-3-4-11-24-20-8-7-16-12-18(6-5-17(16)13-20)21-14-19-9-10-23(2)15-22(19)25-21;2-1(3,4)5/h5-10,12-15H,3-4,11H2,1-2H3;/q+1;-1