ethyl (E)-2-cyano-2-methyl-3-propyl-hex-3-enoate

Systemtic Name: ethyl (E)-2-cyano-2-methyl-3-propyl-hex-3-enoate Openeye Name: ethyl (E)-2-cyano-2-methyl-3-propyl-hex-3-enoate CAS Name: (E)-2-cyano-2-methyl-3-propyl-3-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-2-methyl-3-propylhex-3-enoate Traditional Name: (E)-2-cyano-2-methyl-3-propyl-hex-3-enoic acid ethyl ester Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=CCC)C(C)(C#N)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO2/c1-5-8-11(9-6-2)13(4,10-14)12(15)16-7-3/h8H,5-7,9H2,1-4H3/b11-8+