5,5,7-trimethyl-2-methylidene-octanoate

Systemtic Name: 5,5,7-trimethyl-2-methylidene-octanoate Openeye Name: 5,5,7-trimethyl-2-methylene-octanoate CAS Name: 5,5,7-trimethyl-2-methyleneoctanoate IUPAC Name: 5,5,7-trimethyl-2-methylideneoctanoate Traditional Name: 2-(3,3,5-trimethylhexyl)acrylate Formula: C12H21O2- MolecularWeight: 197.29394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O2/c1-9(2)8-12(4,5)7-6-10(3)11(13)14/h9H,3,6-8H2,1-2,4-5H3,(H,13,14)/p-1