[(3aR,5R,7aS)-7a-methyl-3-oxidanylidene-5-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-2-benzofuran-3a-yl] ethanoate

Systemtic Name: [(3aR,5R,7aS)-7a-methyl-3-oxidanylidene-5-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-2-benzofuran-3a-yl] ethanoate Openeye Name: [(3aR,5R,7aS)-5-isopropenyl-7a-methyl-3-oxo-4,5,6,7-tetrahydro-1H-isobenzofuran-3a-yl] acetate CAS Name: acetic acid [(3aR,5R,7aS)-7a-methyl-5-(1-methylethenyl)-3-oxo-4,5,6,7-tetrahydro-1H-isobenzofuran-3a-yl] ester IUPAC Name: [(3aR,5R,7aS)-7a-methyl-3-oxo-5-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-2-benzofuran-3a-yl] acetate Traditional Name: acetic acid [(3aR,5R,7aS)-5-isopropenyl-3-keto-7a-methyl-4,5,6,7-tetrahydro-1H-isobenzofuran-3a-yl] ester Formula: C14H20O4 MolecularWeight: 252.3062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC2(COC(=O)C2(C1)OC(=O)C)C

Isomeric SMILES

CC(=C)[C@@H]1CC[C@]2(COC(=O)[C@]2(C1)OC(=O)C)C

InChI

InChI=1S/C14H20O4/c1-9(2)11-5-6-13(4)8-17-12(16)14(13,7-11)18-10(3)15/h11H,1,5-8H2,2-4H3/t11-,13+,14+/m1/s1