ethyl 2,2-dimethyl-5,7-bis(oxidanyl)-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate

Systemtic Name: ethyl 2,2-dimethyl-5,7-bis(oxidanyl)-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate Openeye Name: ethyl 5,7-dihydroxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate CAS Name: 5,7-dihydroxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 5,7-dihydroxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylate Traditional Name: 5,7-dihydroxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-1,3-benzodioxole-5-carboxylic acid ethyl ester Formula: C12H20O6 MolecularWeight: 260.2836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C2C(C1)OC(O2)(C)C)O)O

Isomeric SMILES

CCOC(=O)C1(CC(C2C(C1)OC(O2)(C)C)O)O

InChI

InChI=1S/C12H20O6/c1-4-16-10(14)12(15)5-7(13)9-8(6-12)17-11(2,3)18-9/h7-9,13,15H,4-6H2,1-3H3