2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC2=CC=CC=C2C3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC2=CC=CC=C2C3=NC(=C(S3)C(=O)O)C

InChI

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