2-[2-[3-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[3-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[3-(2-morpholin-4-ium-4-ylethoxy)phenyl]thiazol-4-yl]acetate CAS Name: 2-[2-[3-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[3-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-(2-morpholin-4-ium-4-ylethoxy)phenyl]thiazol-4-yl]acetate Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=CC=CC(=C2)C3=NC(=CS3)CC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCOC2=CC=CC(=C2)C3=NC(=CS3)CC(=O)[O-]

InChI

InChI=1S/C17H20N2O4S/c20-16(21)11-14-12-24-17(18-14)13-2-1-3-15(10-13)23-9-6-19-4-7-22-8-5-19/h1-3,10,12H,4-9,11H2,(H,20,21)