(2Z)-4-ethyl-2-ethylidene-octanoate

Systemtic Name: (2Z)-4-ethyl-2-ethylidene-octanoate Openeye Name: (2Z)-4-ethyl-2-ethylidene-octanoate CAS Name: (2Z)-4-ethyl-2-ethylideneoctanoate IUPAC Name: (2Z)-4-ethyl-2-ethylideneoctanoate Traditional Name: (Z)-2-(2-ethylhexyl)but-2-enoate Formula: C12H21O2- MolecularWeight: 197.29394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=CC)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)C/C(=C/C)/C(=O)[O-]

InChI

InChI=1S/C12H22O2/c1-4-7-8-10(5-2)9-11(6-3)12(13)14/h6,10H,4-5,7-9H2,1-3H3,(H,13,14)/p-1/b11-6-