3-(4-carbamothioyl-2-ethoxy-phenoxy)propyl-dimethyl-azanium

Systemtic Name: 3-(4-carbamothioyl-2-ethoxy-phenoxy)propyl-dimethyl-azanium Openeye Name: 3-(4-carbamothioyl-2-ethoxy-phenoxy)propyl-dimethyl-ammonium CAS Name: 3-(4-carbamothioyl-2-ethoxyphenoxy)propyl-dimethylammonium IUPAC Name: 3-(4-carbamothioyl-2-ethoxyphenoxy)propyl-dimethylazanium Traditional Name: 3-(2-ethoxy-4-thiocarbamoyl-phenoxy)propyl-dimethyl-ammonium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2S/c1-4-17-13-10-11(14(15)19)6-7-12(13)18-9-5-8-16(2)3/h6-7,10H,4-5,8-9H2,1-3H3,(H2,15,19)/p+1