4-(2-chloranyl-4-oxidanyl-thioxanthen-9-ylidene)butyl-dimethyl-azanium

Systemtic Name: 4-(2-chloranyl-4-oxidanyl-thioxanthen-9-ylidene)butyl-dimethyl-azanium Openeye Name: 4-(2-chloro-4-hydroxy-thioxanthen-9-ylidene)butyl-dimethyl-ammonium CAS Name: 4-(2-chloro-4-hydroxy-9-thioxanthenylidene)butyl-dimethylammonium IUPAC Name: 4-(2-chloro-4-hydroxythioxanthen-9-ylidene)butyl-dimethylazanium Traditional Name: 4-(2-chloro-4-hydroxy-thioxanthen-9-ylidene)butyl-dimethyl-ammonium Formula: C19H21ClNOS+ MolecularWeight: 346.89414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCC=C1C2=CC=CC=C2SC3=C(C=C(C=C13)Cl)O

Isomeric SMILES

C[NH+](C)CCCC=C1C2=CC=CC=C2SC3=C(C=C(C=C13)Cl)O

InChI

InChI=1S/C19H20ClNOS/c1-21(2)10-6-5-7-14-15-8-3-4-9-18(15)23-19-16(14)11-13(20)12-17(19)22/h3-4,7-9,11-12,22H,5-6,10H2,1-2H3/p+1