3-(2-carbamothioyl-6-methoxy-phenoxy)propyl-dimethyl-azanium

Systemtic Name: 3-(2-carbamothioyl-6-methoxy-phenoxy)propyl-dimethyl-azanium Openeye Name: 3-(2-carbamothioyl-6-methoxy-phenoxy)propyl-dimethyl-ammonium CAS Name: 3-(2-carbamothioyl-6-methoxyphenoxy)propyl-dimethylammonium IUPAC Name: 3-(2-carbamothioyl-6-methoxyphenoxy)propyl-dimethylazanium Traditional Name: 3-(2-methoxy-6-thiocarbamoyl-phenoxy)propyl-dimethyl-ammonium Formula: C13H21N2O2S+ MolecularWeight: 269.38304

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=C(C=CC=C1OC)C(=S)N

Isomeric SMILES

C[NH+](C)CCCOC1=C(C=CC=C1OC)C(=S)N

InChI

InChI=1S/C13H20N2O2S/c1-15(2)8-5-9-17-12-10(13(14)18)6-4-7-11(12)16-3/h4,6-7H,5,8-9H2,1-3H3,(H2,14,18)/p+1