2-[[3-(chloromethyl)phenyl]sulfanyloxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[3-(chloromethyl)phenyl]sulfanyloxy-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[3-(chloromethyl)phenyl]sulfanyloxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[[3-(chloromethyl)phenyl]thio]oxy-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[3-(chloromethyl)phenyl]sulfanyloxy-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[[3-(chloromethyl)phenyl]thio]oxy-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C12H20ClNO4PS+ MolecularWeight: 340.783261

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOP(=O)(O)OSC1=CC=CC(=C1)CCl

Isomeric SMILES

C[N+](C)(C)CCOP(=O)(O)OSC1=CC=CC(=C1)CCl

InChI

InChI=1S/C12H19ClNO4PS/c1-14(2,3)7-8-17-19(15,16)18-20-12-6-4-5-11(9-12)10-13/h4-6,9H,7-8,10H2,1-3H3/p+1