1-ethylsulfanyl-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoranylboron(1-)

Systemtic Name: 1-ethylsulfanyl-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoranylboron(1-) Openeye Name: 1-ethylsulfanyl-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoroboron(1-) CAS Name: 1-(ethylthio)-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoroboron(1-) IUPAC Name: 1-ethylsulfanyl-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoroboron(1-) Traditional Name: 1-(ethylthio)-6,7-dimethoxy-3,4-dihydroisoquinolin-2-ium; fluoroboron(1-) Formula: C13H18BFNO2S MolecularWeight: 282.161923

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Descriptors Computed from Structure

Canonical SMILES:

[B-]F.CCSC1=[NH+]CCC2=CC(=C(C=C21)OC)OC

Isomeric SMILES

[B-]F.CCSC1=[NH+]CCC2=CC(=C(C=C21)OC)OC

InChI

InChI=1S/C13H17NO2S.BF/c1-4-17-13-10-8-12(16-3)11(15-2)7-9(10)5-6-14-13;1-2/h7-8H,4-6H2,1-3H3;/q;-1/p+1