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

Systemtic Name: 2-[4-[2-(4-ethylphenoxy)ethoxy]-3-methoxy-phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[4-[2-(4-ethylphenoxy)ethoxy]-3-methoxy-phenyl]thiazole-4-carboxylate CAS Name: 2-[4-[2-(4-ethylphenoxy)ethoxy]-3-methoxyphenyl]-4-thiazolecarboxylate IUPAC Name: 2-[4-[2-(4-ethylphenoxy)ethoxy]-3-methoxyphenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-[2-(4-ethylphenoxy)ethoxy]-3-methoxy-phenyl]thiazole-4-carboxylate Formula: C21H20NO5S- MolecularWeight: 398.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C3=NC(=CS3)C(=O)[O-])OC

Isomeric SMILES

CCC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C3=NC(=CS3)C(=O)[O-])OC

InChI

InChI=1S/C21H21NO5S/c1-3-14-4-7-16(8-5-14)26-10-11-27-18-9-6-15(12-19(18)25-2)20-22-17(13-28-20)21(23)24/h4-9,12-13H,3,10-11H2,1-2H3,(H,23,24)/p-1