6-cyano-2-ethyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-cyano-2-ethyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 6-cyano-2-ethyl-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 6-cyano-2-ethyl-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 6-cyano-2-ethyl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 6-cyano-2-ethyl-4-keto-1H-quinoline-3-carboxylic acid Formula: C13H10N2O3 MolecularWeight: 242.2301

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=C(N1)C=CC(=C2)C#N)C(=O)O

Isomeric SMILES

CCC1=C(C(=O)C2=C(N1)C=CC(=C2)C#N)C(=O)O

InChI

InChI=1S/C13H10N2O3/c1-2-9-11(13(17)18)12(16)8-5-7(6-14)3-4-10(8)15-9/h3-5H,2H2,1H3,(H,15,16)(H,17,18)