phenyl 4-(3-oxidanylidenebutan-2-yl)pyridine-3-carboxylate

Systemtic Name: phenyl 4-(3-oxidanylidenebutan-2-yl)pyridine-3-carboxylate Openeye Name: phenyl 4-(1-methyl-2-oxo-propyl)pyridine-3-carboxylate CAS Name: 4-(3-oxobutan-2-yl)-3-pyridinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(3-oxobutan-2-yl)pyridine-3-carboxylate Traditional Name: 4-(2-keto-1-methyl-propyl)nicotinic acid phenyl ester Formula: C16H15NO3 MolecularWeight: 269.2952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=NC=C1)C(=O)OC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CC(C1=C(C=NC=C1)C(=O)OC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C16H15NO3/c1-11(12(2)18)14-8-9-17-10-15(14)16(19)20-13-6-4-3-5-7-13/h3-11H,1-2H3