8-[(2-chloranylpyridin-3-yl)carbonylamino]octanoic acid

Systemtic Name: 8-[(2-chloranylpyridin-3-yl)carbonylamino]octanoic acid Openeye Name: 8-[(2-chloropyridine-3-carbonyl)amino]octanoic acid CAS Name: 8-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2-chloropyridine-3-carbonyl)amino]octanoic acid Traditional Name: 8-[(2-chloronicotinoyl)amino]caprylic acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)Cl)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)Cl)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C14H19ClN2O3/c15-13-11(7-6-10-16-13)14(20)17-9-5-3-1-2-4-8-12(18)19/h6-7,10H,1-5,8-9H2,(H,17,20)(H,18,19)