3-(3,3-dimethylbutanoyl)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(3,3-dimethylbutanoyl)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(4-benzyloxy-3-methoxy-phenyl)-3-(3,3-dimethylbutanoyl)thiazolidine-4-carboxylic acid CAS Name: 3-(3,3-dimethyl-1-oxobutyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(3,3-dimethylbutanoyl)-2-(3-methoxy-4-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(4-benzoxy-3-methoxy-phenyl)-3-(3,3-dimethylbutanoyl)thiazolidine-4-carboxylic acid Formula: C24H29NO5S MolecularWeight: 443.55576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1C(CSC1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)O

Isomeric SMILES

CC(C)(C)CC(=O)N1C(CSC1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)O

InChI

InChI=1S/C24H29NO5S/c1-24(2,3)13-21(26)25-18(23(27)28)15-31-22(25)17-10-11-19(20(12-17)29-4)30-14-16-8-6-5-7-9-16/h5-12,18,22H,13-15H2,1-4H3,(H,27,28)