dimethyl 2-[(E)-4-acetyloxyoct-2-enyl]-2-[(4-methylphenyl)methyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-4-acetyloxyoct-2-enyl]-2-[(4-methylphenyl)methyl]propanedioate Openeye Name: dimethyl 2-[(E)-4-acetoxyoct-2-enyl]-2-(p-tolylmethyl)propanedioate CAS Name: 2-[(E)-4-acetyloxyoct-2-enyl]-2-[(4-methylphenyl)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-4-acetyloxyoct-2-enyl]-2-[(4-methylphenyl)methyl]propanedioate Traditional Name: 2-[(E)-4-acetoxyoct-2-enyl]-2-(4-methylbenzyl)malonic acid dimethyl ester Formula: C23H32O6 MolecularWeight: 404.49658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=CCC(CC1=CC=C(C=C1)C)(C(=O)OC)C(=O)OC)OC(=O)C

Isomeric SMILES

CCCCC(/C=C/CC(CC1=CC=C(C=C1)C)(C(=O)OC)C(=O)OC)OC(=O)C

InChI

InChI=1S/C23H32O6/c1-6-7-9-20(29-18(3)24)10-8-15-23(21(25)27-4,22(26)28-5)16-19-13-11-17(2)12-14-19/h8,10-14,20H,6-7,9,15-16H2,1-5H3/b10-8+