3-methyl-1-(2-phenylchromenylium-4-yl)piperidin-1-ium tetrafluoroborate

Systemtic Name: 3-methyl-1-(2-phenylchromenylium-4-yl)piperidin-1-ium tetrafluoroborate Openeye Name: 3-methyl-1-(2-phenylchromenylium-4-yl)piperidin-1-ium tetrafluoroborate CAS Name: 3-methyl-1-(2-phenyl-1-benzopyrylium-4-yl)piperidin-1-ium tetrafluoroborate IUPAC Name: 3-methyl-1-(2-phenylchromenylium-4-yl)piperidin-1-ium tetrafluoroborate Traditional Name: 3-methyl-1-(2-phenyl-1-benzopyrylium-4-yl)piperidin-1-ium tetrafluoroborate Formula: C21H23BF4NO+ MolecularWeight: 392.218033

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1CCC[NH+](C1)C2=CC(=[O+]C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CC1CCC[NH+](C1)C2=CC(=[O+]C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H22NO.BF4/c1-16-8-7-13-22(15-16)19-14-21(17-9-3-2-4-10-17)23-20-12-6-5-11-18(19)20;2-1(3,4)5/h2-6,9-12,14,16H,7-8,13,15H2,1H3;/q+1;-1/p+1