3-butyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: 3-butyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: 3-butyl-4-oxo-1H-quinoline-2-carboxylic acid CAS Name: 3-butyl-4-oxo-1H-quinoline-2-carboxylic acid IUPAC Name: 3-butyl-4-oxo-1H-quinoline-2-carboxylic acid Traditional Name: 3-butyl-4-keto-1H-quinoline-2-carboxylic acid Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC2=CC=CC=C2C1=O)C(=O)O

Isomeric SMILES

CCCCC1=C(NC2=CC=CC=C2C1=O)C(=O)O

InChI

InChI=1S/C14H15NO3/c1-2-3-6-10-12(14(17)18)15-11-8-5-4-7-9(11)13(10)16/h4-5,7-8H,2-3,6H2,1H3,(H,15,16)(H,17,18)