tert-butyl (2R)-5,6-dimethoxy-3-oxidanylidene-2-[(E)-5-oxidanylidenehex-2-enyl]-1H-indene-2-carboxylate

Systemtic Name: tert-butyl (2R)-5,6-dimethoxy-3-oxidanylidene-2-[(E)-5-oxidanylidenehex-2-enyl]-1H-indene-2-carboxylate Openeye Name: tert-butyl (2R)-5,6-dimethoxy-1-oxo-2-[(E)-5-oxohex-2-enyl]indane-2-carboxylate CAS Name: (2R)-5,6-dimethoxy-3-oxo-2-[(E)-5-oxohex-2-enyl]-1H-indene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-5,6-dimethoxy-3-oxo-2-[(E)-5-oxohex-2-enyl]-1H-indene-2-carboxylate Traditional Name: (2R)-1-keto-2-[(E)-5-ketohex-2-enyl]-5,6-dimethoxy-indane-2-carboxylic acid tert-butyl ester Formula: C22H28O6 MolecularWeight: 388.45412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC=CCC1(CC2=CC(=C(C=C2C1=O)OC)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C/C=C/C[C@]1(CC2=CC(=C(C=C2C1=O)OC)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H28O6/c1-14(23)9-7-8-10-22(20(25)28-21(2,3)4)13-15-11-17(26-5)18(27-6)12-16(15)19(22)24/h7-8,11-12H,9-10,13H2,1-6H3/b8-7+/t22-/m1/s1