2-(1,3-benzodioxol-5-ylsulfanyl)ethylazanium

Systemtic Name: 2-(1,3-benzodioxol-5-ylsulfanyl)ethylazanium Openeye Name: 2-(1,3-benzodioxol-5-ylsulfanyl)ethylammonium CAS Name: 2-(1,3-benzodioxol-5-ylthio)ethylammonium IUPAC Name: 2-(1,3-benzodioxol-5-ylsulfanyl)ethylazanium Traditional Name: 2-(1,3-benzodioxol-5-ylthio)ethylammonium Formula: C9H12NO2S+ MolecularWeight: 198.26208

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)SCC[NH3+]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)SCC[NH3+]

InChI

InChI=1S/C9H11NO2S/c10-3-4-13-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3-4,6,10H2/p+1