ethyl 2-oxidanyl-2-(1-pyridin-3-ylethyl)hexanoate

Systemtic Name: ethyl 2-oxidanyl-2-(1-pyridin-3-ylethyl)hexanoate Openeye Name: ethyl 2-hydroxy-2-[1-(3-pyridyl)ethyl]hexanoate CAS Name: 2-hydroxy-2-[1-(3-pyridinyl)ethyl]hexanoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-(1-pyridin-3-ylethyl)hexanoate Traditional Name: 2-hydroxy-2-[1-(3-pyridyl)ethyl]hexanoic acid ethyl ester Formula: C15H23NO3 MolecularWeight: 265.34802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)C1=CN=CC=C1)(C(=O)OCC)O

Isomeric SMILES

CCCCC(C(C)C1=CN=CC=C1)(C(=O)OCC)O

InChI

InChI=1S/C15H23NO3/c1-4-6-9-15(18,14(17)19-5-2)12(3)13-8-7-10-16-11-13/h7-8,10-12,18H,4-6,9H2,1-3H3