1-hexyl-2-oxidanylidene-quinoline-4-carboxylic acid

Systemtic Name: 1-hexyl-2-oxidanylidene-quinoline-4-carboxylic acid Openeye Name: 1-hexyl-2-oxo-quinoline-4-carboxylic acid CAS Name: 1-hexyl-2-oxo-4-quinolinecarboxylic acid IUPAC Name: 1-hexyl-2-oxoquinoline-4-carboxylic acid Traditional Name: 1-hexyl-2-keto-cinchoninic acid Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=CC1=O)C(=O)O

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=CC1=O)C(=O)O

InChI

InChI=1S/C16H19NO3/c1-2-3-4-7-10-17-14-9-6-5-8-12(14)13(16(19)20)11-15(17)18/h5-6,8-9,11H,2-4,7,10H2,1H3,(H,19,20)