2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(2-tert-butyl-4-methylphenoxy)methyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(2-tert-butyl-4-methylphenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-4-methyl-thiazole-5-carboxylic acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NC(=C(S2)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NC(=C(S2)C(=O)O)C)C(C)(C)C

InChI

InChI=1S/C17H21NO3S/c1-10-6-7-13(12(8-10)17(3,4)5)21-9-14-18-11(2)15(22-14)16(19)20/h6-8H,9H2,1-5H3,(H,19,20)