3-[(2S,5R)-5-methyl-2-(2-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: 3-[(2S,5R)-5-methyl-2-(2-methylphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: 3-[(2S,5R)-5-methyl-2-(o-tolyl)-4-oxo-thiazolidin-3-yl]propanoate CAS Name: 3-[(2S,5R)-5-methyl-2-(2-methylphenyl)-4-oxo-3-thiazolidinyl]propanoate IUPAC Name: 3-[(2S,5R)-5-methyl-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[(2S,5R)-4-keto-5-methyl-2-(o-tolyl)thiazolidin-3-yl]propionate Formula: C14H16NO3S- MolecularWeight: 278.34674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC=CC=C2C)CCC(=O)[O-]

Isomeric SMILES

C[C@@H]1C(=O)N([C@@H](S1)C2=CC=CC=C2C)CCC(=O)[O-]

InChI

InChI=1S/C14H17NO3S/c1-9-5-3-4-6-11(9)14-15(8-7-12(16)17)13(18)10(2)19-14/h3-6,10,14H,7-8H2,1-2H3,(H,16,17)/p-1/t10-,14+/m1/s1