(phenylmethyl) 3-oxidanylidene-4-(2-pyridin-2-ylethoxy)butanoate

Systemtic Name: (phenylmethyl) 3-oxidanylidene-4-(2-pyridin-2-ylethoxy)butanoate Openeye Name: benzyl 3-oxo-4-[2-(2-pyridyl)ethoxy]butanoate CAS Name: 3-oxo-4-[2-(2-pyridinyl)ethoxy]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxo-4-(2-pyridin-2-ylethoxy)butanoate Traditional Name: 3-keto-4-[2-(2-pyridyl)ethoxy]butyric acid benzyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(=O)COCCC2=CC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC(=O)COCCC2=CC=CC=N2

InChI

InChI=1S/C18H19NO4/c20-17(14-22-11-9-16-8-4-5-10-19-16)12-18(21)23-13-15-6-2-1-3-7-15/h1-8,10H,9,11-14H2