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

Systemtic Name: 2-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[4-(2-tert-butyl-4-methylphenoxy)phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[4-(2-tert-butyl-4-methylphenoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[4-(2-tert-butyl-4-methyl-phenoxy)phenyl]-4-methyl-thiazole-5-carboxylic acid Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=CC=C(C=C2)C3=NC(=C(S3)C(=O)O)C)C(C)(C)C

InChI

InChI=1S/C22H23NO3S/c1-13-6-11-18(17(12-13)22(3,4)5)26-16-9-7-15(8-10-16)20-23-14(2)19(27-20)21(24)25/h6-12H,1-5H3,(H,24,25)