2-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[3-[2-(diethylammonio)ethoxy]phenyl]-4-ethyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-(diethylammonio)ethoxy]phenyl]-4-ethyl-5-thiazolecarboxylate IUPAC Name: 2-[3-[2-(diethylazaniumyl)ethoxy]phenyl]-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-[2-(diethylammonio)ethoxy]phenyl]-4-ethyl-thiazole-5-carboxylate Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=CC(=CC=C2)OCC[NH+](CC)CC)C(=O)[O-]

Isomeric SMILES

CCC1=C(SC(=N1)C2=CC(=CC=C2)OCC[NH+](CC)CC)C(=O)[O-]

InChI

InChI=1S/C18H24N2O3S/c1-4-15-16(18(21)22)24-17(19-15)13-8-7-9-14(12-13)23-11-10-20(5-2)6-3/h7-9,12H,4-6,10-11H2,1-3H3,(H,21,22)