2-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[4-[2-(dimethylammonio)ethoxy]phenyl]thiazole-4-carboxylate CAS Name: 2-[4-[2-(dimethylammonio)ethoxy]phenyl]-4-thiazolecarboxylate IUPAC Name: 2-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-[2-(dimethylammonio)ethoxy]phenyl]thiazole-4-carboxylate Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S/c1-16(2)7-8-19-11-5-3-10(4-6-11)13-15-12(9-20-13)14(17)18/h3-6,9H,7-8H2,1-2H3,(H,17,18)