2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]thiazole-4-carboxylate CAS Name: 2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]-4-thiazolecarboxylate IUPAC Name: 2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[3-[2-(2,3,5-trimethylphenoxy)ethoxy]phenyl]thiazole-4-carboxylate Formula: C21H20NO4S- MolecularWeight: 382.4528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO4S/c1-13-9-14(2)15(3)19(10-13)26-8-7-25-17-6-4-5-16(11-17)20-22-18(12-27-20)21(23)24/h4-6,9-12H,7-8H2,1-3H3,(H,23,24)/p-1