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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)C3=NC(=CS3)C(=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)C3=NC(=CS3)C(=O)[O-])OC)C

InChI

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