(4S)-3-(1,3-benzodioxol-5-ylcarbonyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: (4S)-3-(1,3-benzodioxol-5-ylcarbonyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: (4S)-3-(1,3-benzodioxole-5-carbonyl)thiazolidine-4-carboxylic acid CAS Name: (4S)-3-[1,3-benzodioxol-5-yl(oxo)methyl]-4-thiazolidinecarboxylic acid IUPAC Name: (4S)-3-(1,3-benzodioxole-5-carbonyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: (4S)-3-piperonyloylthiazolidine-4-carboxylic acid Formula: C12H11NO5S MolecularWeight: 281.28444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CS1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

C1[C@@H](N(CS1)C(=O)C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C12H11NO5S/c14-11(13-5-19-4-8(13)12(15)16)7-1-2-9-10(3-7)18-6-17-9/h1-3,8H,4-6H2,(H,15,16)/t8-/m1/s1