2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxy-phenyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxy-phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxy-phenyl]thiazole-4-carboxylate CAS Name: 2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxyphenyl]-4-thiazolecarboxylate IUPAC Name: 2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxyphenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[4-[2-(2,6-dimethylphenoxy)ethoxy]-3-methoxy-phenyl]thiazole-4-carboxylate Formula: C21H20NO5S- MolecularWeight: 398.4522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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