dimethyl 2-[(E)-3-(1-acetyloxyethyl)-8-phenyl-oct-3-enyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-3-(1-acetyloxyethyl)-8-phenyl-oct-3-enyl]propanedioate Openeye Name: dimethyl 2-[(E)-3-(1-acetoxyethyl)-8-phenyl-oct-3-enyl]propanedioate CAS Name: 2-[(E)-3-(1-acetyloxyethyl)-8-phenyloct-3-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-3-(1-acetyloxyethyl)-8-phenyloct-3-enyl]propanedioate Traditional Name: 2-[(E)-3-(1-acetoxyethyl)-8-phenyl-oct-3-enyl]malonic acid dimethyl ester Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=CCCCCC1=CC=CC=C1)CCC(C(=O)OC)C(=O)OC)OC(=O)C

Isomeric SMILES

CC(/C(=C/CCCCC1=CC=CC=C1)/CCC(C(=O)OC)C(=O)OC)OC(=O)C

InChI

InChI=1S/C23H32O6/c1-17(29-18(2)24)20(15-16-21(22(25)27-3)23(26)28-4)14-10-6-9-13-19-11-7-5-8-12-19/h5,7-8,11-12,14,17,21H,6,9-10,13,15-16H2,1-4H3/b20-14+