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

Systemtic Name: 2-[2-[2-(diethylazaniumyl)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[2-[2-(diethylammonio)ethoxy]phenyl]thiazole-4-carboxylate CAS Name: 2-[2-[2-(diethylammonio)ethoxy]phenyl]-4-thiazolecarboxylate IUPAC Name: 2-[2-[2-(diethylazaniumyl)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[2-[2-(diethylammonio)ethoxy]phenyl]thiazole-4-carboxylate Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=CC=C1C2=NC(=CS2)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=CC=C1C2=NC(=CS2)C(=O)[O-]

InChI

InChI=1S/C16H20N2O3S/c1-3-18(4-2)9-10-21-14-8-6-5-7-12(14)15-17-13(11-22-15)16(19)20/h5-8,11H,3-4,9-10H2,1-2H3,(H,19,20)