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

Systemtic Name: ethyl 4-[3,4,5-tris(bromanyl)pyrazol-1-yl]butanoate Openeye Name: ethyl 4-(3,4,5-tribromopyrazol-1-yl)butanoate CAS Name: 4-(3,4,5-tribromo-1-pyrazolyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(3,4,5-tribromopyrazol-1-yl)butanoate Traditional Name: 4-(3,4,5-tribromopyrazol-1-yl)butyric acid ethyl ester Formula: C9H11Br3N2O2 MolecularWeight: 418.90784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=C(C(=N1)Br)Br)Br

Isomeric SMILES

CCOC(=O)CCCN1C(=C(C(=N1)Br)Br)Br

InChI

InChI=1S/C9H11Br3N2O2/c1-2-16-6(15)4-3-5-14-9(12)7(10)8(11)13-14/h2-5H2,1H3