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

Systemtic Name: 2-[2-[2-[2-(dimethylazaniumyl)ethoxy]-3-methoxy-phenyl]-1,3-thiazol-4-yl]ethanoate Openeye Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-3-methoxy-phenyl]thiazol-4-yl]acetate CAS Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-3-methoxyphenyl]-4-thiazolyl]acetate IUPAC Name: 2-[2-[2-[2-(dimethylazaniumyl)ethoxy]-3-methoxyphenyl]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[2-(dimethylammonio)ethoxy]-3-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=C1OC)C2=NC(=CS2)CC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCOC1=C(C=CC=C1OC)C2=NC(=CS2)CC(=O)[O-]

InChI

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