2-[2-[3-(4-tert-butylphenoxy)phenyl]-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[3-(4-tert-butylphenoxy)phenyl]-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]ethanoic acid Openeye Name: 2-[2-[3-(4-tert-butylphenoxy)phenyl]-5-methyl-4-oxo-thiazolidin-3-yl]acetic acid CAS Name: 2-[2-[3-(4-tert-butylphenoxy)phenyl]-5-methyl-4-oxo-3-thiazolidinyl]acetic acid IUPAC Name: 2-[2-[3-(4-tert-butylphenoxy)phenyl]-5-methyl-4-oxo-1,3-thiazolidin-3-yl]acetic acid Traditional Name: 2-[2-[3-(4-tert-butylphenoxy)phenyl]-4-keto-5-methyl-thiazolidin-3-yl]acetic acid Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC(=CC=C2)OC3=CC=C(C=C3)C(C)(C)C)CC(=O)O

Isomeric SMILES

CC1C(=O)N(C(S1)C2=CC(=CC=C2)OC3=CC=C(C=C3)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C22H25NO4S/c1-14-20(26)23(13-19(24)25)21(28-14)15-6-5-7-18(12-15)27-17-10-8-16(9-11-17)22(2,3)4/h5-12,14,21H,13H2,1-4H3,(H,24,25)