trimethyl-[(E)-3-phenylsulfanylprop-2-enyl]azanium iodide

Systemtic Name: trimethyl-[(E)-3-phenylsulfanylprop-2-enyl]azanium iodide Openeye Name: trimethyl-[(E)-3-phenylsulfanylallyl]ammonium iodide CAS Name: trimethyl-[(E)-3-(phenylthio)prop-2-enyl]ammonium iodide IUPAC Name: trimethyl-[(E)-3-phenylsulfanylprop-2-enyl]azanium iodide Traditional Name: trimethyl-[(E)-3-(phenylthio)allyl]ammonium iodide Formula: C12H18INS MolecularWeight: 335.24749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC=CSC1=CC=CC=C1.[I-]

Isomeric SMILES

C[N+](C)(C)C/C=C/SC1=CC=CC=C1.[I-]

InChI

InChI=1S/C12H18NS.HI/c1-13(2,3)10-7-11-14-12-8-5-4-6-9-12;/h4-9,11H,10H2,1-3H3;1H/q+1;/p-1/b11-7+;