4-[[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]methyl]benzoic acid

Systemtic Name: 4-[[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]methyl]benzoic acid Openeye Name: 4-[[3-(2-oxothiazolidin-3-yl)propanoylamino]methyl]benzoic acid CAS Name: 4-[[[1-oxo-3-(2-oxo-3-thiazolidinyl)propyl]amino]methyl]benzoic acid IUPAC Name: 4-[[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]methyl]benzoic acid Traditional Name: 4-[[3-(2-ketothiazolidin-3-yl)propanoylamino]methyl]benzoic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)N1CCC(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CSC(=O)N1CCC(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c17-12(5-6-16-7-8-21-14(16)20)15-9-10-1-3-11(4-2-10)13(18)19/h1-4H,5-9H2,(H,15,17)(H,18,19)