[(3Z)-3-(2-chloranylthioxanthen-9-ylidene)propyl]-trimethyl-azanium iodide

Systemtic Name: [(3Z)-3-(2-chloranylthioxanthen-9-ylidene)propyl]-trimethyl-azanium iodide Openeye Name: [(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]-trimethyl-ammonium iodide CAS Name: [(3Z)-3-(2-chloro-9-thioxanthenylidene)propyl]-trimethylammonium iodide IUPAC Name: [(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]-trimethylazanium iodide Traditional Name: [(3Z)-3-(2-chlorothioxanthen-9-ylidene)propyl]-trimethyl-ammonium iodide Formula: C19H21ClINS MolecularWeight: 457.79921

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[I-]

Isomeric SMILES

C[N+](C)(C)CC/C=C\1/C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.[I-]

InChI

InChI=1S/C19H21ClNS.HI/c1-21(2,3)12-6-8-15-16-7-4-5-9-18(16)22-19-11-10-14(20)13-17(15)19;/h4-5,7-11,13H,6,12H2,1-3H3;1H/q+1;/p-1/b15-8-;