O1-ethyl O5-methyl (2E)-4-cyano-2-hexylidene-pentanedioate

Systemtic Name: O1-ethyl O5-methyl (2E)-4-cyano-2-hexylidene-pentanedioate Openeye Name: O1-ethyl O5-methyl (2E)-4-cyano-2-hexylidene-pentanedioate CAS Name: (2E)-4-cyano-2-hexylidenepentanedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl (2E)-4-cyano-2-hexylidenepentanedioate Traditional Name: (2E)-4-cyano-2-hexylidene-glutaric acid O1-ethyl ester O5-methyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(CC(C#N)C(=O)OC)C(=O)OCC

Isomeric SMILES

CCCCC/C=C(\CC(C#N)C(=O)OC)/C(=O)OCC

InChI

InChI=1S/C15H23NO4/c1-4-6-7-8-9-12(15(18)20-5-2)10-13(11-16)14(17)19-3/h9,13H,4-8,10H2,1-3H3/b12-9+