(phenylmethyl) 3-oxidanylidene-2-(3-oxidanylidenebutyl)-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) 3-oxidanylidene-2-(3-oxidanylidenebutyl)-2H-pyridine-1-carboxylate Openeye Name: benzyl 3-oxo-2-(3-oxobutyl)-2H-pyridine-1-carboxylate CAS Name: 3-oxo-2-(3-oxobutyl)-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxo-2-(3-oxobutyl)-2H-pyridine-1-carboxylate Traditional Name: 3-keto-2-(3-ketobutyl)-2H-pyridine-1-carboxylic acid benzyl ester Formula: C17H18NO4 MolecularWeight: 300.32912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1C(=O)[CH][CH][CH]N1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)CCC1C(=O)[CH][CH][CH]N1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H18NO4/c1-13(19)9-10-15-16(20)8-5-11-18(15)17(21)22-12-14-6-3-2-4-7-14/h2-8,11,15H,9-10,12H2,1H3