[6-aminocarbonyl-2,4-bis(bromanyl)pyridin-3-yl] octanoate

Systemtic Name: [6-aminocarbonyl-2,4-bis(bromanyl)pyridin-3-yl] octanoate Openeye Name: (2,4-dibromo-6-carbamoyl-3-pyridyl) octanoate CAS Name: octanoic acid (2,4-dibromo-6-carbamoyl-3-pyridinyl) ester IUPAC Name: (2,4-dibromo-6-carbamoylpyridin-3-yl) octanoate Traditional Name: caprylic acid (2,4-dibromo-6-carbamoyl-3-pyridyl) ester Formula: C14H18Br2N2O3 MolecularWeight: 422.11232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=C(N=C(C=C1Br)C(=O)N)Br

Isomeric SMILES

CCCCCCCC(=O)OC1=C(N=C(C=C1Br)C(=O)N)Br

InChI

InChI=1S/C14H18Br2N2O3/c1-2-3-4-5-6-7-11(19)21-12-9(15)8-10(14(17)20)18-13(12)16/h8H,2-7H2,1H3,(H2,17,20)