4-oxidanylidene-1-pentyl-7-pyridin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-1-pentyl-7-pyridin-4-yl-quinoline-3-carboxylic acid Openeye Name: 4-oxo-1-pentyl-7-(4-pyridyl)quinoline-3-carboxylic acid CAS Name: 4-oxo-1-pentyl-7-pyridin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 4-oxo-1-pentyl-7-pyridin-4-ylquinoline-3-carboxylic acid Traditional Name: 1-amyl-4-keto-7-(4-pyridyl)quinoline-3-carboxylic acid Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O

Isomeric SMILES

CCCCCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C20H20N2O3/c1-2-3-4-11-22-13-17(20(24)25)19(23)16-6-5-15(12-18(16)22)14-7-9-21-10-8-14/h5-10,12-13H,2-4,11H2,1H3,(H,24,25)