4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbothioamide

Systemtic Name: 4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbothioamide Openeye Name: 4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbothioamide CAS Name: 4-[2-(4-morpholin-4-iumyl)ethoxy]benzenecarbothioamide IUPAC Name: 4-(2-morpholin-4-ium-4-ylethoxy)benzenecarbothioamide Traditional Name: 4-(2-morpholin-4-ium-4-ylethoxy)thiobenzamide Formula: C13H19N2O2S+ MolecularWeight: 267.36716

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1COCC[NH+]1CCOC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H18N2O2S/c14-13(18)11-1-3-12(4-2-11)17-10-7-15-5-8-16-9-6-15/h1-4H,5-10H2,(H2,14,18)/p+1