1-[2-(4-methoxyphenyl)chromen-4-ylidene]-4-methyl-piperidin-1-ium tetrafluoroborate

Systemtic Name: 1-[2-(4-methoxyphenyl)chromen-4-ylidene]-4-methyl-piperidin-1-ium tetrafluoroborate Openeye Name: 1-[2-(4-methoxyphenyl)chromen-4-ylidene]-4-methyl-piperidin-1-ium tetrafluoroborate CAS Name: 1-[2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]-4-methylpiperidin-1-ium tetrafluoroborate IUPAC Name: 1-[2-(4-methoxyphenyl)chromen-4-ylidene]-4-methylpiperidin-1-ium tetrafluoroborate Traditional Name: 1-[2-(4-methoxyphenyl)chromen-4-ylidene]-4-methyl-piperidin-1-ium tetrafluoroborate Formula: C22H24BF4NO2 MolecularWeight: 421.236073

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1CC[N+](=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)OC)CC1

Isomeric SMILES

[B-](F)(F)(F)F.CC1CC[N+](=C2C=C(OC3=CC=CC=C32)C4=CC=C(C=C4)OC)CC1

InChI

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