(9-butylsulfanylphenalen-1-ylidene)-ethyl-oxidanium tetrafluoroborate

Systemtic Name: (9-butylsulfanylphenalen-1-ylidene)-ethyl-oxidanium tetrafluoroborate Openeye Name: (9-butylsulfanylphenalen-1-ylidene)-ethyl-oxonium tetrafluoroborate CAS Name: [9-(butylthio)-1-phenalenylidene]-ethyloxonium tetrafluoroborate IUPAC Name: (9-butylsulfanylphenalen-1-ylidene)-ethyloxidanium tetrafluoroborate Traditional Name: [9-(butylthio)phenalen-1-ylidene]-ethyl-oxonium tetrafluoroborate Formula: C19H21BF4OS MolecularWeight: 384.239053

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCSC1=C2C(=[O+]CC)C=CC3=CC=CC(=C32)C=C1

Isomeric SMILES

[B-](F)(F)(F)F.CCCCSC1=C2C(=[O+]CC)C=CC3=CC=CC(=C32)C=C1

InChI

InChI=1S/C19H21OS.BF4/c1-3-5-13-21-17-12-10-15-8-6-7-14-9-11-16(20-4-2)19(17)18(14)15;2-1(3,4)5/h6-12H,3-5,13H2,1-2H3;/q+1;-1