2-(4-methoxy-3-phenylmethoxy-phenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(4-methoxy-3-phenylmethoxy-phenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(3-benzyloxy-4-methoxy-phenyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylic acid CAS Name: 2-(4-methoxy-3-phenylmethoxyphenyl)-3-(3,5,5-trimethyl-1-oxohexyl)-4-thiazolidinecarboxylic acid IUPAC Name: 2-(4-methoxy-3-phenylmethoxyphenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(3-benzoxy-4-methoxy-phenyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylic acid Formula: C27H35NO5S MolecularWeight: 485.6355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35NO5S/c1-18(15-27(2,3)4)13-24(29)28-21(26(30)31)17-34-25(28)20-11-12-22(32-5)23(14-20)33-16-19-9-7-6-8-10-19/h6-12,14,18,21,25H,13,15-17H2,1-5H3,(H,30,31)