6-bromanyl-2-(2-pyridin-2-ylethyl)hexanoate

Systemtic Name: 6-bromanyl-2-(2-pyridin-2-ylethyl)hexanoate Openeye Name: 6-bromo-2-[2-(2-pyridyl)ethyl]hexanoate CAS Name: 6-bromo-2-[2-(2-pyridinyl)ethyl]hexanoate IUPAC Name: 6-bromo-2-(2-pyridin-2-ylethyl)hexanoate Traditional Name: 6-bromo-2-[2-(2-pyridyl)ethyl]hexanoate Formula: C13H17BrNO2- MolecularWeight: 299.18358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCC(CCCCBr)C(=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CCC(CCCCBr)C(=O)[O-]

InChI

InChI=1S/C13H18BrNO2/c14-9-3-1-5-11(13(16)17)7-8-12-6-2-4-10-15-12/h2,4,6,10-11H,1,3,5,7-9H2,(H,16,17)/p-1