7-[(5-bromanylpyridin-3-yl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(5-bromanylpyridin-3-yl)carbonylamino]heptanoic acid Openeye Name: 7-[(5-bromopyridine-3-carbonyl)amino]heptanoic acid CAS Name: 7-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(5-bromopyridine-3-carbonyl)amino]heptanoic acid Traditional Name: 7-[(5-bromonicotinoyl)amino]enanthic acid Formula: C13H17BrN2O3 MolecularWeight: 329.18968

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC=C1Br)C(=O)NCCCCCCC(=O)O

Isomeric SMILES

C1=C(C=NC=C1Br)C(=O)NCCCCCCC(=O)O

InChI

InChI=1S/C13H17BrN2O3/c14-11-7-10(8-15-9-11)13(19)16-6-4-2-1-3-5-12(17)18/h7-9H,1-6H2,(H,16,19)(H,17,18)