2-[2-[3-[2-(diethylazaniumyl)ethoxy]-4-methoxy-phenyl]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 2-[2-[3-[2-(diethylazaniumyl)ethoxy]-4-methoxy-phenyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[3-[2-(diethylammonio)ethoxy]-4-methoxy-phenyl]thiazol-4-yl]acetate CAS Name: 2-[2-[3-[2-(diethylammonio)ethoxy]-4-methoxyphenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[3-[2-(diethylazaniumyl)ethoxy]-4-methoxyphenyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-[2-(diethylammonio)ethoxy]-4-methoxy-phenyl]thiazol-4-yl]acetate Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=CC(=C1)C2=NC(=CS2)CC(=O)[O-])OC

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=CC(=C1)C2=NC(=CS2)CC(=O)[O-])OC

InChI

InChI=1S/C18H24N2O4S/c1-4-20(5-2)8-9-24-16-10-13(6-7-15(16)23-3)18-19-14(12-25-18)11-17(21)22/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,21,22)