ethyl 6-(2-methylpropyl)-2-oxidanylidene-5-pyridin-4-yl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 6-(2-methylpropyl)-2-oxidanylidene-5-pyridin-4-yl-1H-pyridine-3-carboxylate Openeye Name: ethyl 6-isobutyl-2-oxo-5-(4-pyridyl)-1H-pyridine-3-carboxylate CAS Name: 6-(2-methylpropyl)-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-methylpropyl)-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carboxylate Traditional Name: 6-isobutyl-2-keto-5-(4-pyridyl)-1H-pyridine-3-carboxylic acid ethyl ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(NC1=O)CC(C)C)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C1=CC(=C(NC1=O)CC(C)C)C2=CC=NC=C2

InChI

InChI=1S/C17H20N2O3/c1-4-22-17(21)14-10-13(12-5-7-18-8-6-12)15(9-11(2)3)19-16(14)20/h5-8,10-11H,4,9H2,1-3H3,(H,19,20)