2-nonan-2-yl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-nonan-2-yl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 2-(1-methyloctyl)-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 2-nonan-2-yl-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 2-nonan-2-yl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-2-(1-methyloctyl)-1H-quinoline-3-carboxylic acid Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)C1=C(C(=O)C2=CC=CC=C2N1)C(=O)O

Isomeric SMILES

CCCCCCCC(C)C1=C(C(=O)C2=CC=CC=C2N1)C(=O)O

InChI

InChI=1S/C19H25NO3/c1-3-4-5-6-7-10-13(2)17-16(19(22)23)18(21)14-11-8-9-12-15(14)20-17/h8-9,11-13H,3-7,10H2,1-2H3,(H,20,21)(H,22,23)