(4E)-4-ethoxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylic acid

Systemtic Name: (4E)-4-ethoxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromene-6-carboxylic acid Openeye Name: (4E)-4-ethoxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylic acid CAS Name: (4E)-4-ethoxyimino-5-methyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-6-carboxylic acid IUPAC Name: (4E)-4-ethoxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carboxylic acid Traditional Name: (4E)-4-ethyloximino-1,1-diketo-5-methyl-2,3-dihydrothiochromene-6-carboxylic acid Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON=C1CCS(=O)(=O)C2=C1C(=C(C=C2)C(=O)O)C

Isomeric SMILES

CCO/N=C/1\CCS(=O)(=O)C2=C1C(=C(C=C2)C(=O)O)C

InChI

InChI=1S/C13H15NO5S/c1-3-19-14-10-6-7-20(17,18)11-5-4-9(13(15)16)8(2)12(10)11/h4-5H,3,6-7H2,1-2H3,(H,15,16)/b14-10+