3-(6-fluoranyl-2-propan-2-yl-thioxanthen-9-ylidene)propyl-dimethyl-azanium

Systemtic Name: 3-(6-fluoranyl-2-propan-2-yl-thioxanthen-9-ylidene)propyl-dimethyl-azanium Openeye Name: 3-(6-fluoro-2-isopropyl-thioxanthen-9-ylidene)propyl-dimethyl-ammonium CAS Name: 3-(6-fluoro-2-propan-2-yl-9-thioxanthenylidene)propyl-dimethylammonium IUPAC Name: 3-(6-fluoro-2-propan-2-ylthioxanthen-9-ylidene)propyl-dimethylazanium Traditional Name: 3-(6-fluoro-2-isopropyl-thioxanthen-9-ylidene)propyl-dimethyl-ammonium Formula: C21H25FNS+ MolecularWeight: 342.493303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)SC3=C(C2=CCC[NH+](C)C)C=CC(=C3)F

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)SC3=C(C2=CCC[NH+](C)C)C=CC(=C3)F

InChI

InChI=1S/C21H24FNS/c1-14(2)15-7-10-20-19(12-15)17(6-5-11-23(3)4)18-9-8-16(22)13-21(18)24-20/h6-10,12-14H,5,11H2,1-4H3/p+1