2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(3-methylsulfanylpropyl)azanium

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(3-methylsulfanylpropyl)azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(3-methylsulfanylpropyl)ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[3-(methylthio)propyl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(3-methylsulfanylpropyl)azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[3-(methylthio)propyl]ammonium Formula: C14H22NO2S+ MolecularWeight: 268.39498

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH2+]CCC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CSCCC[NH2+]CCC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C14H21NO2S/c1-18-10-2-6-15-7-5-12-3-4-13-14(11-12)17-9-8-16-13/h3-4,11,15H,2,5-10H2,1H3/p+1