5-(4-bromanylbutyl)pyridine-2-carboxylate

Systemtic Name: 5-(4-bromanylbutyl)pyridine-2-carboxylate Openeye Name: 5-(4-bromobutyl)pyridine-2-carboxylate CAS Name: 5-(4-bromobutyl)-2-pyridinecarboxylate IUPAC Name: 5-(4-bromobutyl)pyridine-2-carboxylate Traditional Name: 5-(4-bromobutyl)picolinate Formula: C10H11BrNO2- MolecularWeight: 257.10384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1CCCCBr)C(=O)[O-]

Isomeric SMILES

C1=CC(=NC=C1CCCCBr)C(=O)[O-]

InChI

InChI=1S/C10H12BrNO2/c11-6-2-1-3-8-4-5-9(10(13)14)12-7-8/h4-5,7H,1-3,6H2,(H,13,14)/p-1