2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid

Systemtic Name: 2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid Openeye Name: 2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid CAS Name: 2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid IUPAC Name: 2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid Traditional Name: 2-ethyl-5,6-dihydro-4H-pyrrolo[3,2-e][1,3]benzothiazole-8-carboxylic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(S1)CCC3=C2C(=CN3)C(=O)O

Isomeric SMILES

CCC1=NC2=C(S1)CCC3=C2C(=CN3)C(=O)O

InChI

InChI=1S/C12H12N2O2S/c1-2-9-14-11-8(17-9)4-3-7-10(11)6(5-13-7)12(15)16/h5,13H,2-4H2,1H3,(H,15,16)