4-ethyl-2-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 4-ethyl-2-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazole-5-carboxylate Openeye Name: 4-ethyl-2-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]thiazole-5-carboxylate CAS Name: 4-ethyl-2-[4-methoxy-2-[2-(4-morpholin-4-iumyl)ethoxy]phenyl]-5-thiazolecarboxylate IUPAC Name: 4-ethyl-2-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]-1,3-thiazole-5-carboxylate Traditional Name: 4-ethyl-2-[4-methoxy-2-(2-morpholin-4-ium-4-ylethoxy)phenyl]thiazole-5-carboxylate Formula: C19H24N2O5S MolecularWeight: 392.46926

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=C(C=C(C=C2)OC)OCC[NH+]3CCOCC3)C(=O)[O-]

Isomeric SMILES

CCC1=C(SC(=N1)C2=C(C=C(C=C2)OC)OCC[NH+]3CCOCC3)C(=O)[O-]

InChI

InChI=1S/C19H24N2O5S/c1-3-15-17(19(22)23)27-18(20-15)14-5-4-13(24-2)12-16(14)26-11-8-21-6-9-25-10-7-21/h4-5,12H,3,6-11H2,1-2H3,(H,22,23)