heptyl (E)-4-oxidanylidenepent-2-enoate

Systemtic Name: heptyl (E)-4-oxidanylidenepent-2-enoate Openeye Name: heptyl (E)-4-oxopent-2-enoate CAS Name: (E)-4-oxo-2-pentenoic acid heptyl ester IUPAC Name: heptyl (E)-4-oxopent-2-enoate Traditional Name: (E)-4-ketopent-2-enoic acid heptyl ester Formula: C12H20O3 MolecularWeight: 212.2854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C=CC(=O)C

Isomeric SMILES

CCCCCCCOC(=O)/C=C/C(=O)C

InChI

InChI=1S/C12H20O3/c1-3-4-5-6-7-10-15-12(14)9-8-11(2)13/h8-9H,3-7,10H2,1-2H3/b9-8+