3-(2-chloranyl-3-fluoranyl-thioxanthen-9-ylidene)propyl-dimethyl-azanium

Systemtic Name: 3-(2-chloranyl-3-fluoranyl-thioxanthen-9-ylidene)propyl-dimethyl-azanium Openeye Name: 3-(2-chloro-3-fluoro-thioxanthen-9-ylidene)propyl-dimethyl-ammonium CAS Name: 3-(2-chloro-3-fluoro-9-thioxanthenylidene)propyl-dimethylammonium IUPAC Name: 3-(2-chloro-3-fluorothioxanthen-9-ylidene)propyl-dimethylazanium Traditional Name: 3-(2-chloro-3-fluoro-thioxanthen-9-ylidene)propyl-dimethyl-ammonium Formula: C18H18ClFNS+ MolecularWeight: 334.858623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC=C1C2=CC=CC=C2SC3=CC(=C(C=C31)Cl)F

Isomeric SMILES

C[NH+](C)CCC=C1C2=CC=CC=C2SC3=CC(=C(C=C31)Cl)F

InChI

InChI=1S/C18H17ClFNS/c1-21(2)9-5-7-12-13-6-3-4-8-17(13)22-18-11-16(20)15(19)10-14(12)18/h3-4,6-8,10-11H,5,9H2,1-2H3/p+1