methyl 8-methylsulfonyl-4-oxidanylidene-1H-quinoline-2-carboxylate

Systemtic Name: methyl 8-methylsulfonyl-4-oxidanylidene-1H-quinoline-2-carboxylate Openeye Name: methyl 8-methylsulfonyl-4-oxo-1H-quinoline-2-carboxylate CAS Name: 8-methylsulfonyl-4-oxo-1H-quinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 8-methylsulfonyl-4-oxo-1H-quinoline-2-carboxylate Traditional Name: 4-keto-8-mesyl-1H-quinoline-2-carboxylic acid methyl ester Formula: C12H11NO5S MolecularWeight: 281.28444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)C2=C(N1)C(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=O)C2=C(N1)C(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C12H11NO5S/c1-18-12(15)8-6-9(14)7-4-3-5-10(11(7)13-8)19(2,16)17/h3-6H,1-2H3,(H,13,14)