1-(2-methylpropyl)-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-methylpropyl)-4-oxidanylidene-7-pyridin-4-yl-quinoline-3-carboxylic acid Openeye Name: 1-isobutyl-4-oxo-7-(4-pyridyl)quinoline-3-carboxylic acid CAS Name: 1-(2-methylpropyl)-4-oxo-7-pyridin-4-yl-3-quinolinecarboxylic acid IUPAC Name: 1-(2-methylpropyl)-4-oxo-7-pyridin-4-ylquinoline-3-carboxylic acid Traditional Name: 1-isobutyl-4-keto-7-(4-pyridyl)quinoline-3-carboxylic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O

Isomeric SMILES

CC(C)CN1C=C(C(=O)C2=C1C=C(C=C2)C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C19H18N2O3/c1-12(2)10-21-11-16(19(23)24)18(22)15-4-3-14(9-17(15)21)13-5-7-20-8-6-13/h3-9,11-12H,10H2,1-2H3,(H,23,24)