5-(1-benzothiophen-3-yl)-1-ethyl-2,3,3-trimethyl-indol-1-ium tetrafluoroborate

Systemtic Name: 5-(1-benzothiophen-3-yl)-1-ethyl-2,3,3-trimethyl-indol-1-ium tetrafluoroborate Openeye Name: 5-(benzothiophen-3-yl)-1-ethyl-2,3,3-trimethyl-indol-1-ium tetrafluoroborate CAS Name: 5-(1-benzothiophen-3-yl)-1-ethyl-2,3,3-trimethylindol-1-ium tetrafluoroborate IUPAC Name: 5-(1-benzothiophen-3-yl)-1-ethyl-2,3,3-trimethylindol-1-ium tetrafluoroborate Traditional Name: 5-(benzothiophen-3-yl)-1-ethyl-2,3,3-trimethyl-indol-1-ium tetrafluoroborate Formula: C21H22BF4NS MolecularWeight: 407.275693

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC[N+]1=C(C(C2=C1C=CC(=C2)C3=CSC4=CC=CC=C43)(C)C)C

Isomeric SMILES

[B-](F)(F)(F)F.CC[N+]1=C(C(C2=C1C=CC(=C2)C3=CSC4=CC=CC=C43)(C)C)C

InChI

InChI=1S/C21H22NS.BF4/c1-5-22-14(2)21(3,4)18-12-15(10-11-19(18)22)17-13-23-20-9-7-6-8-16(17)20;2-1(3,4)5/h6-13H,5H2,1-4H3;/q+1;-1