(3-methylidene-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-1-benzofuran-7-yl) 2-methylpropanoate

Systemtic Name: (3-methylidene-2-oxidanylidene-3a,4,5,6,7,7a-hexahydro-1-benzofuran-7-yl) 2-methylpropanoate Openeye Name: (3-methylene-2-oxo-3a,4,5,6,7,7a-hexahydrobenzofuran-7-yl) 2-methylpropanoate CAS Name: 2-methylpropanoic acid (3-methylene-2-oxo-3a,4,5,6,7,7a-hexahydrobenzofuran-7-yl) ester IUPAC Name: (3-methylidene-2-oxo-3a,4,5,6,7,7a-hexahydro-1-benzofuran-7-yl) 2-methylpropanoate Traditional Name: 2-methylpropionic acid (2-keto-3-methylene-3a,4,5,6,7,7a-hexahydrobenzofuran-7-yl) ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1CCCC2C1OC(=O)C2=C

Isomeric SMILES

CC(C)C(=O)OC1CCCC2C1OC(=O)C2=C

InChI

InChI=1S/C13H18O4/c1-7(2)12(14)16-10-6-4-5-9-8(3)13(15)17-11(9)10/h7,9-11H,3-6H2,1-2H3