ethyl (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-1-benzofuran-3-carboxylate

Systemtic Name: ethyl (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-1-benzofuran-3-carboxylate Openeye Name: ethyl (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-carboxylate CAS Name: (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-1-benzofuran-3-carboxylate Traditional Name: (3aS,7aS)-2,7a-dimethyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-carboxylic acid ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2(C1CCCC2)C)C

Isomeric SMILES

CCOC(=O)C1=C(O[C@@]2([C@H]1CCCC2)C)C

InChI

InChI=1S/C13H20O3/c1-4-15-12(14)11-9(2)16-13(3)8-6-5-7-10(11)13/h10H,4-8H2,1-3H3/t10-,13-/m0/s1