2-[2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(2-tert-butyl-4-methyl-phenoxy)methyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(2-tert-butyl-4-methyl-phenoxy)methyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(2-tert-butyl-4-methylphenoxy)methyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(2-tert-butyl-4-methylphenoxy)methyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(2-tert-butyl-4-methyl-phenoxy)methyl]thiazol-4-yl]acetic acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC2=NC(=CS2)CC(=O)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCC2=NC(=CS2)CC(=O)O)C(C)(C)C

InChI

InChI=1S/C17H21NO3S/c1-11-5-6-14(13(7-11)17(2,3)4)21-9-15-18-12(10-22-15)8-16(19)20/h5-7,10H,8-9H2,1-4H3,(H,19,20)