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

Systemtic Name: 2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[3-ethoxy-4-(m-tolylmethoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[3-ethoxy-4-(3-methylbenzyl)oxy-phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C21H21NO4S MolecularWeight: 383.46074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OCC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC(=C(S2)C(=O)O)C)OCC3=CC=CC(=C3)C

InChI

InChI=1S/C21H21NO4S/c1-4-25-18-11-16(20-22-14(3)19(27-20)21(23)24)8-9-17(18)26-12-15-7-5-6-13(2)10-15/h5-11H,4,12H2,1-3H3,(H,23,24)