hexyl 2-[3,4,5-tris(bromanyl)pyrazol-1-yl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CN1C(=C(C(=N1)Br)Br)Br

Isomeric SMILES

CCCCCCOC(=O)CN1C(=C(C(=N1)Br)Br)Br

InChI

InChI=1S/C11H15Br3N2O2/c1-2-3-4-5-6-18-8(17)7-16-11(14)9(12)10(13)15-16/h2-7H2,1H3