2-methoxyethyl (2S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]pyrrolidine-2-carboxylate

Systemtic Name: 2-methoxyethyl (2S)-1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]pyrrolidine-2-carboxylate Openeye Name: 2-methoxyethyl (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)-2-pyrrolidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (2S)-1-(1,1-dioxo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(1,1-diketo-1,2-benzothiazol-3-yl)pyrrolidine-2-carboxylic acid 2-methoxyethyl ester Formula: C15H18N2O5S MolecularWeight: 338.37882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1CCCN1C2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

COCCOC(=O)[C@@H]1CCCN1C2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C15H18N2O5S/c1-21-9-10-22-15(18)12-6-4-8-17(12)14-11-5-2-3-7-13(11)23(19,20)16-14/h2-3,5,7,12H,4,6,8-10H2,1H3/t12-/m0/s1