dimethyl 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]propanedioate

Systemtic Name: dimethyl 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]propanedioate Openeye Name: dimethyl 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]propanedioate CAS Name: 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]propanedioate Traditional Name: 2-[(2E,4E)-5-phenylpenta-2,4-dienyl]malonic acid dimethyl ester Formula: C16H18O4 MolecularWeight: 274.31172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=CC=CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(C/C=C/C=C/C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C16H18O4/c1-19-15(17)14(16(18)20-2)12-8-4-7-11-13-9-5-3-6-10-13/h3-11,14H,12H2,1-2H3/b8-4+,11-7+