3-hexanoyl-2-(4-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-hexanoyl-2-(4-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-3-hexanoyl-thiazolidine-4-carboxylic acid CAS Name: 3-(1-oxohexyl)-2-(4-phenylmethoxyphenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-hexanoyl-2-(4-phenylmethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-3-caproyl-thiazolidine-4-carboxylic acid Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO4S/c1-2-3-5-10-21(25)24-20(23(26)27)16-29-22(24)18-11-13-19(14-12-18)28-15-17-8-6-4-7-9-17/h4,6-9,11-14,20,22H,2-3,5,10,15-16H2,1H3,(H,26,27)