dimethyl (3aS,6R,7aR)-6-acetyloxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate

Systemtic Name: dimethyl (3aS,6R,7aR)-6-acetyloxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate Openeye Name: dimethyl (3aS,6R,7aR)-6-acetoxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate CAS Name: (3aS,6R,7aR)-6-acetyloxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3aS,6R,7aR)-6-acetyloxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylate Traditional Name: (3aS,6R,7aR)-6-acetoxy-3-cyclohexyl-3a,6,7,7a-tetrahydroindene-1,1-dicarboxylic acid dimethyl ester Formula: C21H28O6 MolecularWeight: 376.44342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2C(C=C1)C(=CC2(C(=O)OC)C(=O)OC)C3CCCCC3

Isomeric SMILES

CC(=O)O[C@@H]1C[C@@H]2[C@H](C=C1)C(=CC2(C(=O)OC)C(=O)OC)C3CCCCC3

InChI

InChI=1S/C21H28O6/c1-13(22)27-15-9-10-16-17(14-7-5-4-6-8-14)12-21(18(16)11-15,19(23)25-2)20(24)26-3/h9-10,12,14-16,18H,4-8,11H2,1-3H3/t15-,16+,18+/m0/s1