methyl (3aS,7aR)-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]-5-carboxylate

Systemtic Name: methyl (3aS,7aR)-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]-5-carboxylate Openeye Name: methyl (3aS,7aR)-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]-5-carboxylate CAS Name: (3aS,7aR)-5-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]carboxylic acid methyl ester IUPAC Name: methyl (3aS,7aR)-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]-5-carboxylate Traditional Name: (3aS,7aR)-spiro[3a,7a-dihydro-1,3-benzodioxole-2,1'-cyclohexane]-5-carboxylic acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2C(C=C1)OC3(O2)CCCCC3

Isomeric SMILES

COC(=O)C1=C[C@H]2[C@@H](C=C1)OC3(O2)CCCCC3

InChI

InChI=1S/C14H18O4/c1-16-13(15)10-5-6-11-12(9-10)18-14(17-11)7-3-2-4-8-14/h5-6,9,11-12H,2-4,7-8H2,1H3/t11-,12+/m1/s1