2-(4-carbamothioyl-2-chloranyl-6-ethoxy-phenoxy)ethyl-dimethyl-azanium

Systemtic Name: 2-(4-carbamothioyl-2-chloranyl-6-ethoxy-phenoxy)ethyl-dimethyl-azanium Openeye Name: 2-(4-carbamothioyl-2-chloro-6-ethoxy-phenoxy)ethyl-dimethyl-ammonium CAS Name: 2-(4-carbamothioyl-2-chloro-6-ethoxyphenoxy)ethyl-dimethylammonium IUPAC Name: 2-(4-carbamothioyl-2-chloro-6-ethoxyphenoxy)ethyl-dimethylazanium Traditional Name: 2-(2-chloro-6-ethoxy-4-thiocarbamoyl-phenoxy)ethyl-dimethyl-ammonium Formula: C13H20ClN2O2S+ MolecularWeight: 303.8281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCC[NH+](C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCC[NH+](C)C

InChI

InChI=1S/C13H19ClN2O2S/c1-4-17-11-8-9(13(15)19)7-10(14)12(11)18-6-5-16(2)3/h7-8H,4-6H2,1-3H3,(H2,15,19)/p+1