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

Systemtic Name: 2-[2-[2-[2-(dimethylazaniumyl)ethoxy]-4-methoxy-phenyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-4-methoxy-phenyl]thiazol-4-yl]acetate CAS Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-4-methoxyphenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[2-[2-(dimethylazaniumyl)ethoxy]-4-methoxyphenyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-4-methoxy-phenyl]thiazol-4-yl]acetate Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4S/c1-18(2)6-7-22-14-9-12(21-3)4-5-13(14)16-17-11(10-23-16)8-15(19)20/h4-5,9-10H,6-8H2,1-3H3,(H,19,20)