dimethyl 2-[(E)-2-phenacyl-4-phenyl-but-3-enyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-2-phenacyl-4-phenyl-but-3-enyl]propanedioate Openeye Name: dimethyl 2-[(E)-2-phenacyl-4-phenyl-but-3-enyl]propanedioate CAS Name: 2-[(E)-2-phenacyl-4-phenylbut-3-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-2-phenacyl-4-phenylbut-3-enyl]propanedioate Traditional Name: 2-[(E)-2-phenacyl-4-phenyl-but-3-enyl]malonic acid dimethyl ester Formula: C23H24O5 MolecularWeight: 380.43366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(CC(=O)C1=CC=CC=C1)C=CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C(CC(CC(=O)C1=CC=CC=C1)/C=C/C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C23H24O5/c1-27-22(25)20(23(26)28-2)15-18(14-13-17-9-5-3-6-10-17)16-21(24)19-11-7-4-8-12-19/h3-14,18,20H,15-16H2,1-2H3/b14-13+