3-(2-chloranyl-7-oxidanyl-thioxanthen-9-ylidene)propyl-dimethyl-azanium

Systemtic Name: 3-(2-chloranyl-7-oxidanyl-thioxanthen-9-ylidene)propyl-dimethyl-azanium Openeye Name: 3-(2-chloro-7-hydroxy-thioxanthen-9-ylidene)propyl-dimethyl-ammonium CAS Name: 3-(2-chloro-7-hydroxy-9-thioxanthenylidene)propyl-dimethylammonium IUPAC Name: 3-(2-chloro-7-hydroxythioxanthen-9-ylidene)propyl-dimethylazanium Traditional Name: 3-(2-chloro-7-hydroxy-thioxanthen-9-ylidene)propyl-dimethyl-ammonium Formula: C18H19ClNOS+ MolecularWeight: 332.86756

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC=C1C2=C(C=CC(=C2)O)SC3=C1C=C(C=C3)Cl

Isomeric SMILES

C[NH+](C)CCC=C1C2=C(C=CC(=C2)O)SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C18H18ClNOS/c1-20(2)9-3-4-14-15-10-12(19)5-7-17(15)22-18-8-6-13(21)11-16(14)18/h4-8,10-11,21H,3,9H2,1-2H3/p+1