4-[[(2R)-2-tert-butyl-3-methanoyl-1,3-thiazolidin-4-yl]carbonyl]benzoic acid

Systemtic Name: 4-[[(2R)-2-tert-butyl-3-methanoyl-1,3-thiazolidin-4-yl]carbonyl]benzoic acid Openeye Name: 4-[(2R)-2-tert-butyl-3-formyl-thiazolidine-4-carbonyl]benzoic acid CAS Name: 4-[[(2R)-2-tert-butyl-3-formyl-4-thiazolidinyl]-oxomethyl]benzoic acid IUPAC Name: 4-[(2R)-2-tert-butyl-3-formyl-1,3-thiazolidine-4-carbonyl]benzoic acid Traditional Name: 4-[(2R)-2-tert-butyl-3-formyl-thiazolidine-4-carbonyl]benzoic acid Formula: C16H19NO4S MolecularWeight: 321.39136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1N(C(CS1)C(=O)C2=CC=C(C=C2)C(=O)O)C=O

Isomeric SMILES

CC(C)(C)[C@@H]1N(C(CS1)C(=O)C2=CC=C(C=C2)C(=O)O)C=O

InChI

InChI=1S/C16H19NO4S/c1-16(2,3)15-17(9-18)12(8-22-15)13(19)10-4-6-11(7-5-10)14(20)21/h4-7,9,12,15H,8H2,1-3H3,(H,20,21)/t12?,15-/m1/s1