2-(2,6-ditert-butylpyran-4-ylidene)-4-phenyl-pyrrol-1-ium tetrafluoroborate

Systemtic Name: 2-(2,6-ditert-butylpyran-4-ylidene)-4-phenyl-pyrrol-1-ium tetrafluoroborate Openeye Name: 2-(2,6-ditert-butylpyran-4-ylidene)-4-phenyl-pyrrol-1-ium tetrafluoroborate CAS Name: 2-(2,6-ditert-butyl-4-pyranylidene)-4-phenylpyrrol-1-ium tetrafluoroborate IUPAC Name: 2-(2,6-ditert-butylpyran-4-ylidene)-4-phenylpyrrol-1-ium tetrafluoroborate Traditional Name: 2-(2,6-ditert-butylpyran-4-ylidene)-4-phenyl-pyrrol-1-ium tetrafluoroborate Formula: C23H28BF4NO MolecularWeight: 421.279133

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=C2C=C(C=[NH+]2)C3=CC=CC=C3)C=C(O1)C(C)(C)C

Isomeric SMILES

[B-](F)(F)(F)F.CC(C)(C)C1=CC(=C2C=C(C=[NH+]2)C3=CC=CC=C3)C=C(O1)C(C)(C)C

InChI

InChI=1S/C23H27NO.BF4/c1-22(2,3)20-13-17(14-21(25-20)23(4,5)6)19-12-18(15-24-19)16-10-8-7-9-11-16;2-1(3,4)5/h7-15H,1-6H3;/q;-1/p+1