4-[(E)-2-(4,6-ditert-butylpyrylium-2-yl)ethenyl]-2-methoxy-phenol tetrafluoroborate

Systemtic Name: 4-[(E)-2-(4,6-ditert-butylpyrylium-2-yl)ethenyl]-2-methoxy-phenol tetrafluoroborate Openeye Name: 4-[(E)-2-(4,6-ditert-butylpyrylium-2-yl)vinyl]-2-methoxy-phenol tetrafluoroborate CAS Name: 4-[(E)-2-(4,6-ditert-butyl-2-pyryliumyl)ethenyl]-2-methoxyphenol tetrafluoroborate IUPAC Name: 4-[(E)-2-(4,6-ditert-butylpyrylium-2-yl)ethenyl]-2-methoxyphenol tetrafluoroborate Traditional Name: 4-[(E)-2-(4,6-ditert-butylpyrylium-2-yl)vinyl]-2-methoxy-phenol tetrafluoroborate Formula: C22H29BF4O3 MolecularWeight: 428.268473

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=[O+]C(=C1)C(C)(C)C)C=CC2=CC(=C(C=C2)O)OC

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=[O+]C(=C1)C(C)(C)C)/C=C/C2=CC(=C(C=C2)O)OC

InChI

InChI=1S/C22H28O3.BF4/c1-21(2,3)16-13-17(25-20(14-16)22(4,5)6)10-8-15-9-11-18(23)19(12-15)24-7;2-1(3,4)5/h8-14H,1-7H3;/q;-1/p+1/b10-8+;