dimethyl 2-[(1S)-1-pyridin-2-ylprop-2-enyl]propanedioate

Systemtic Name: dimethyl 2-[(1S)-1-pyridin-2-ylprop-2-enyl]propanedioate Openeye Name: dimethyl 2-[(1S)-1-(2-pyridyl)allyl]propanedioate CAS Name: 2-[(1S)-1-(2-pyridinyl)prop-2-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1S)-1-pyridin-2-ylprop-2-enyl]propanedioate Traditional Name: 2-[(1S)-1-(2-pyridyl)allyl]malonic acid dimethyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C=C)C1=CC=CC=N1)C(=O)OC

Isomeric SMILES

COC(=O)C([C@H](C=C)C1=CC=CC=N1)C(=O)OC

InChI

InChI=1S/C13H15NO4/c1-4-9(10-7-5-6-8-14-10)11(12(15)17-2)13(16)18-3/h4-9,11H,1H2,2-3H3/t9-/m1/s1