pyridin-4-yl 2-ethyl-2-methanoyl-5-oxidanylidene-hexanoate

Systemtic Name: pyridin-4-yl 2-ethyl-2-methanoyl-5-oxidanylidene-hexanoate Openeye Name: 4-pyridyl 2-ethyl-2-formyl-5-oxo-hexanoate CAS Name: 2-ethyl-2-formyl-5-oxohexanoic acid pyridin-4-yl ester IUPAC Name: pyridin-4-yl 2-ethyl-2-formyl-5-oxohexanoate Traditional Name: 2-ethyl-2-formyl-5-keto-hexanoic acid 4-pyridyl ester Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)C)(C=O)C(=O)OC1=CC=NC=C1

Isomeric SMILES

CCC(CCC(=O)C)(C=O)C(=O)OC1=CC=NC=C1

InChI

InChI=1S/C14H17NO4/c1-3-14(10-16,7-4-11(2)17)13(18)19-12-5-8-15-9-6-12/h5-6,8-10H,3-4,7H2,1-2H3