5,7-diethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: 5,7-diethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: 5,7-diethyl-4-oxo-1H-quinoline-2-carboxylic acid CAS Name: 5,7-diethyl-4-oxo-1H-quinoline-2-carboxylic acid IUPAC Name: 5,7-diethyl-4-oxo-1H-quinoline-2-carboxylic acid Traditional Name: 5,7-diethyl-4-keto-1H-quinoline-2-carboxylic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=C1)NC(=CC2=O)C(=O)O)CC

Isomeric SMILES

CCC1=CC(=C2C(=C1)NC(=CC2=O)C(=O)O)CC

InChI

InChI=1S/C14H15NO3/c1-3-8-5-9(4-2)13-10(6-8)15-11(14(17)18)7-12(13)16/h5-7H,3-4H2,1-2H3,(H,15,16)(H,17,18)