O1-ethyl O3-(3-pyridin-3-ylpropyl) 2-ethylpropanedioate

Systemtic Name: O1-ethyl O3-(3-pyridin-3-ylpropyl) 2-ethylpropanedioate Openeye Name: O1-ethyl O3-[3-(3-pyridyl)propyl] 2-ethylpropanedioate CAS Name: 2-ethylpropanedioic acid O1-ethyl ester O3-[3-(3-pyridinyl)propyl] ester IUPAC Name: 1-O-ethyl 3-O-(3-pyridin-3-ylpropyl) 2-ethylpropanedioate Traditional Name: 2-ethylmalonic acid O1-ethyl ester O3-[3-(3-pyridyl)propyl] ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)C(=O)OCCCC1=CN=CC=C1

Isomeric SMILES

CCC(C(=O)OCC)C(=O)OCCCC1=CN=CC=C1

InChI

InChI=1S/C15H21NO4/c1-3-13(14(17)19-4-2)15(18)20-10-6-8-12-7-5-9-16-11-12/h5,7,9,11,13H,3-4,6,8,10H2,1-2H3