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

Systemtic Name: 2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Openeye Name: 2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]thiazole-4-carboxylate CAS Name: 2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]-4-thiazolecarboxylate IUPAC Name: 2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[3-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]thiazole-4-carboxylate Formula: C21H20NO4S- MolecularWeight: 382.4528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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