ethyl 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]hexanoate

Systemtic Name: ethyl 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]hexanoate Openeye Name: ethyl 2-(3,4,5-tribromopyrazol-1-yl)hexanoate CAS Name: 2-(3,4,5-tribromo-1-pyrazolyl)hexanoic acid ethyl ester IUPAC Name: ethyl 2-(3,4,5-tribromopyrazol-1-yl)hexanoate Traditional Name: 2-(3,4,5-tribromopyrazol-1-yl)hexanoic acid ethyl ester Formula: C11H15Br3N2O2 MolecularWeight: 446.961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)N1C(=C(C(=N1)Br)Br)Br

Isomeric SMILES

CCCCC(C(=O)OCC)N1C(=C(C(=N1)Br)Br)Br

InChI

InChI=1S/C11H15Br3N2O2/c1-3-5-6-7(11(17)18-4-2)16-10(14)8(12)9(13)15-16/h7H,3-6H2,1-2H3