trimethyl-[2-(3-phenylpropanoylsulfanyl)ethyl]azanium

Systemtic Name: trimethyl-[2-(3-phenylpropanoylsulfanyl)ethyl]azanium Openeye Name: trimethyl-[2-(3-phenylpropanoylsulfanyl)ethyl]ammonium CAS Name: trimethyl-[2-[(1-oxo-3-phenylpropyl)thio]ethyl]ammonium IUPAC Name: trimethyl-[2-(3-phenylpropanoylsulfanyl)ethyl]azanium Traditional Name: 2-(hydrocinnamoylthio)ethyl-trimethyl-ammonium Formula: C14H22NOS+ MolecularWeight: 252.39558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCSC(=O)CCC1=CC=CC=C1

Isomeric SMILES

C[N+](C)(C)CCSC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C14H22NOS/c1-15(2,3)11-12-17-14(16)10-9-13-7-5-4-6-8-13/h4-8H,9-12H2,1-3H3/q+1