6-chloranyl-1-ethyl-7-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-ethyl-7-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-ethyl-7-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-chloro-1-ethyl-7-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-ethyl-7-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-chloro-1-ethyl-4-keto-7-methoxy-quinoline-3-carboxylic acid Formula: C13H12ClNO4 MolecularWeight: 281.69168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)OC)Cl)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)OC)Cl)C(=O)O

InChI

InChI=1S/C13H12ClNO4/c1-3-15-6-8(13(17)18)12(16)7-4-9(14)11(19-2)5-10(7)15/h4-6H,3H2,1-2H3,(H,17,18)