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methyl (3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate

methyl (3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate

Systemtic Name:methyl (3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
Openeye Name:methyl (3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
CAS Name:(3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid methyl ester
IUPAC Name:methyl (3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
Traditional Name:(3aS,7aR)-2,2-dimethyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylic acid methyl ester
Formula: C11H16O4
MolecularWeight: 212.24234
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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2CCC(=CC2O1)C(=O)OC)C


Isomeric SMILES

CC1(O[C@@H]2CCC(=C[C@@H]2O1)C(=O)OC)C


InChI

InChI=1S/C11H16O4/c1-11(2)14-8-5-4-7(10(12)13-3)6-9(8)15-11/h6,8-9H,4-5H2,1-3H3/t8-,9+/m1/s1


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