ethyl (E)-2-(3-bromanylpropyl)-2-cyano-3-ethyl-pent-3-enoate

Systemtic Name: ethyl (E)-2-(3-bromanylpropyl)-2-cyano-3-ethyl-pent-3-enoate Openeye Name: ethyl (E)-2-(3-bromopropyl)-2-cyano-3-ethyl-pent-3-enoate CAS Name: (E)-2-(3-bromopropyl)-2-cyano-3-ethyl-3-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(3-bromopropyl)-2-cyano-3-ethylpent-3-enoate Traditional Name: (E)-2-(3-bromopropyl)-2-cyano-3-ethyl-pent-3-enoic acid ethyl ester Formula: C13H20BrNO2 MolecularWeight: 302.2074

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC)C(CCCBr)(C#N)C(=O)OCC

Isomeric SMILES

CC/C(=C\C)/C(CCCBr)(C#N)C(=O)OCC

InChI

InChI=1S/C13H20BrNO2/c1-4-11(5-2)13(10-15,8-7-9-14)12(16)17-6-3/h4H,5-9H2,1-3H3/b11-4+