trimethyl-[2-oxidanyl-3-(9-oxidanylidenethioxanthen-3-yl)oxy-propyl]azanium

Systemtic Name: trimethyl-[2-oxidanyl-3-(9-oxidanylidenethioxanthen-3-yl)oxy-propyl]azanium Openeye Name: [2-hydroxy-3-(9-oxothioxanthen-3-yl)oxy-propyl]-trimethyl-ammonium CAS Name: [2-hydroxy-3-[(9-oxo-3-thioxanthenyl)oxy]propyl]-trimethylammonium IUPAC Name: [2-hydroxy-3-(9-oxothioxanthen-3-yl)oxypropyl]-trimethylazanium Traditional Name: [2-hydroxy-3-(9-ketothioxanthen-3-yl)oxy-propyl]-trimethyl-ammonium Formula: C19H22NO3S+ MolecularWeight: 344.44788

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2)O

Isomeric SMILES

C[N+](C)(C)CC(COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3S2)O

InChI

InChI=1S/C19H22NO3S/c1-20(2,3)11-13(21)12-23-14-8-9-16-18(10-14)24-17-7-5-4-6-15(17)19(16)22/h4-10,13,21H,11-12H2,1-3H3/q+1