ditert-butyl (3aS)-6-methyl-5-oxidanylidene-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate

Systemtic Name: ditert-butyl (3aS)-6-methyl-5-oxidanylidene-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate Openeye Name: ditert-butyl (3aS)-6-methyl-5-oxo-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate CAS Name: (3aS)-6-methyl-5-oxo-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (3aS)-6-methyl-5-oxo-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylate Traditional Name: (3aS)-5-keto-6-methyl-1,3,3a,4-tetrahydropentalene-2,2-dicarboxylic acid ditert-butyl ester Formula: C19H28O5 MolecularWeight: 336.42262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CC(CC2CC1=O)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C2CC(C[C@H]2CC1=O)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H28O5/c1-11-13-10-19(9-12(13)8-14(11)20,15(21)23-17(2,3)4)16(22)24-18(5,6)7/h12H,8-10H2,1-7H3/t12-/m1/s1