heptanoyl 5-bromanylpyridine-2-carboxylate

Systemtic Name: heptanoyl 5-bromanylpyridine-2-carboxylate Openeye Name: heptanoyl 5-bromopyridine-2-carboxylate CAS Name: 5-bromo-2-pyridinecarboxylic acid 1-oxoheptyl ester IUPAC Name: heptanoyl 5-bromopyridine-2-carboxylate Traditional Name: 5-bromopicolinic acid enanthyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(=O)C1=NC=C(C=C1)Br

Isomeric SMILES

CCCCCCC(=O)OC(=O)C1=NC=C(C=C1)Br

InChI

InChI=1S/C13H16BrNO3/c1-2-3-4-5-6-12(16)18-13(17)11-8-7-10(14)9-15-11/h7-9H,2-6H2,1H3