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

Systemtic Name: [(3aR,5R,7aR)-7a-methyl-3,3a,4,5-tetrahydro-2H-1-benzofuran-5-yl] ethanoate Openeye Name: [(3aR,5R,7aR)-7a-methyl-3,3a,4,5-tetrahydro-2H-benzofuran-5-yl] acetate CAS Name: acetic acid [(3aR,5R,7aR)-7a-methyl-3,3a,4,5-tetrahydro-2H-benzofuran-5-yl] ester IUPAC Name: [(3aR,5R,7aR)-7a-methyl-3,3a,4,5-tetrahydro-2H-1-benzofuran-5-yl] acetate Traditional Name: acetic acid [(3aR,5R,7aR)-7a-methyl-3,3a,4,5-tetrahydro-2H-benzofuran-5-yl] ester Formula: C11H16O3 MolecularWeight: 196.24294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2CCOC2(C=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C11H16O3/c1-8(12)14-10-3-5-11(2)9(7-10)4-6-13-11/h3,5,9-10H,4,6-7H2,1-2H3/t9-,10+,11+/m1/s1