2-(4-methylphenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(4-methylphenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 2-(p-tolyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylic acid CAS Name: 2-(4-methylphenyl)-3-(3,5,5-trimethyl-1-oxohexyl)-4-thiazolidinecarboxylic acid IUPAC Name: 2-(4-methylphenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 2-(p-tolyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylic acid Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2N(C(CS2)C(=O)O)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C20H29NO3S/c1-13-6-8-15(9-7-13)18-21(16(12-25-18)19(23)24)17(22)10-14(2)11-20(3,4)5/h6-9,14,16,18H,10-12H2,1-5H3,(H,23,24)