dimethyl (1S,5R)-5-but-3-enyl-4-oxidanylidene-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylate

Systemtic Name: dimethyl (1S,5R)-5-but-3-enyl-4-oxidanylidene-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylate Openeye Name: dimethyl (1S,5R)-5-but-3-enyl-4-oxo-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylate CAS Name: (1S,5R)-5-but-3-enyl-4-oxo-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,5R)-5-but-3-enyl-4-oxo-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylate Traditional Name: (1S,5R)-5-but-3-enyl-4-keto-1-phenyl-8-oxabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylic acid dimethyl ester Formula: C21H22O6 MolecularWeight: 370.39578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2(C(=O)CCC1(O2)C3=CC=CC=C3)CCC=C)C(=O)OC

Isomeric SMILES

COC(=O)C1=C([C@@]2(C(=O)CC[C@]1(O2)C3=CC=CC=C3)CCC=C)C(=O)OC

InChI

InChI=1S/C21H22O6/c1-4-5-12-21-15(22)11-13-20(27-21,14-9-7-6-8-10-14)16(18(23)25-2)17(21)19(24)26-3/h4,6-10H,1,5,11-13H2,2-3H3/t20-,21-/m0/s1