(2S,4S)-2-[4-(cyanomethoxy)-3-ethoxy-phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: (2S,4S)-2-[4-(cyanomethoxy)-3-ethoxy-phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: (2S,4S)-2-[4-(cyanomethoxy)-3-ethoxy-phenyl]thiazolidine-4-carboxylic acid CAS Name: (2S,4S)-2-[4-(cyanomethoxy)-3-ethoxyphenyl]-4-thiazolidinecarboxylic acid IUPAC Name: (2S,4S)-2-[4-(cyanomethoxy)-3-ethoxyphenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: (2S,4S)-2-[4-(cyanomethoxy)-3-ethoxy-phenyl]thiazolidine-4-carboxylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2NC(CS2)C(=O)O)OCC#N

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H]2N[C@H](CS2)C(=O)O)OCC#N

InChI

InChI=1S/C14H16N2O4S/c1-2-19-12-7-9(3-4-11(12)20-6-5-15)13-16-10(8-21-13)14(17)18/h3-4,7,10,13,16H,2,6,8H2,1H3,(H,17,18)/t10-,13+/m1/s1