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

Systemtic Name: 2-[4-[2-(diethylazaniumyl)ethoxy]-3-ethoxy-phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[4-[2-(diethylammonio)ethoxy]-3-ethoxy-phenyl]thiazole-4-carboxylate CAS Name: 2-[4-[2-(diethylammonio)ethoxy]-3-ethoxyphenyl]-4-thiazolecarboxylate IUPAC Name: 2-[4-[2-(diethylazaniumyl)ethoxy]-3-ethoxyphenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-[2-(diethylammonio)ethoxy]-3-ethoxy-phenyl]thiazole-4-carboxylate Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O4S/c1-4-20(5-2)9-10-24-15-8-7-13(11-16(15)23-6-3)17-19-14(12-25-17)18(21)22/h7-8,11-12H,4-6,9-10H2,1-3H3,(H,21,22)