[(2S)-1-but-3-enoxy-1-oxidanylidene-3-phenyl-propan-2-yl] 3-oxidanylidenecyclohexene-1-carboxylate

Systemtic Name: [(2S)-1-but-3-enoxy-1-oxidanylidene-3-phenyl-propan-2-yl] 3-oxidanylidenecyclohexene-1-carboxylate Openeye Name: [(1S)-1-benzyl-2-but-3-enoxy-2-oxo-ethyl] 3-oxocyclohexene-1-carboxylate CAS Name: 3-oxo-1-cyclohexenecarboxylic acid [(2S)-1-but-3-enoxy-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [(2S)-1-but-3-enoxy-1-oxo-3-phenylpropan-2-yl] 3-oxocyclohexene-1-carboxylate Traditional Name: 3-ketocyclohexene-1-carboxylic acid [(1S)-1-benzyl-2-but-3-enoxy-2-keto-ethyl] ester Formula: C20H22O5 MolecularWeight: 342.38568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCOC(=O)C(CC1=CC=CC=C1)OC(=O)C2=CC(=O)CCC2

Isomeric SMILES

C=CCCOC(=O)[C@H](CC1=CC=CC=C1)OC(=O)C2=CC(=O)CCC2

InChI

InChI=1S/C20H22O5/c1-2-3-12-24-20(23)18(13-15-8-5-4-6-9-15)25-19(22)16-10-7-11-17(21)14-16/h2,4-6,8-9,14,18H,1,3,7,10-13H2/t18-/m0/s1