6-butyl-2-pyridin-4-yl-quinoline-4-carboxylic acid

Systemtic Name: 6-butyl-2-pyridin-4-yl-quinoline-4-carboxylic acid Openeye Name: 6-butyl-2-(4-pyridyl)quinoline-4-carboxylic acid CAS Name: 6-butyl-2-pyridin-4-yl-4-quinolinecarboxylic acid IUPAC Name: 6-butyl-2-pyridin-4-ylquinoline-4-carboxylic acid Traditional Name: 6-butyl-2-(4-pyridyl)cinchoninic acid Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=NC=C3

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C19H18N2O2/c1-2-3-4-13-5-6-17-15(11-13)16(19(22)23)12-18(21-17)14-7-9-20-10-8-14/h5-12H,2-4H2,1H3,(H,22,23)