(1-bromanyl-1-cyano-pent-3-ynyl) ethanoate

Systemtic Name: (1-bromanyl-1-cyano-pent-3-ynyl) ethanoate Openeye Name: (1-bromo-1-cyano-pent-3-ynyl) acetate CAS Name: acetic acid (1-bromo-1-cyanopent-3-ynyl) ester IUPAC Name: (1-bromo-1-cyanopent-3-ynyl) acetate Traditional Name: acetic acid (1-bromo-1-cyano-pent-3-ynyl) ester Formula: C8H8BrNO2 MolecularWeight: 230.05862

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C#N)(OC(=O)C)Br

Isomeric SMILES

CC#CCC(C#N)(OC(=O)C)Br

InChI

InChI=1S/C8H8BrNO2/c1-3-4-5-8(9,6-10)12-7(2)11/h5H2,1-2H3