4-[[4-[(E)-2-(4-bromophenyl)ethenyl]phenyl]methyl]heptane-3,5-dione

Systemtic Name: 4-[[4-[(E)-2-(4-bromophenyl)ethenyl]phenyl]methyl]heptane-3,5-dione Openeye Name: 4-[[4-[(E)-2-(4-bromophenyl)vinyl]phenyl]methyl]heptane-3,5-dione CAS Name: 4-[[4-[(E)-2-(4-bromophenyl)ethenyl]phenyl]methyl]heptane-3,5-dione IUPAC Name: 4-[[4-[(E)-2-(4-bromophenyl)ethenyl]phenyl]methyl]heptane-3,5-dione Traditional Name: 4-[4-[(E)-2-(4-bromophenyl)vinyl]benzyl]heptane-3,5-dione Formula: C22H23BrO2 MolecularWeight: 399.32082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC1=CC=C(C=C1)C=CC2=CC=C(C=C2)Br)C(=O)CC

Isomeric SMILES

CCC(=O)C(CC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)Br)C(=O)CC

InChI

InChI=1S/C22H23BrO2/c1-3-21(24)20(22(25)4-2)15-18-9-7-16(8-10-18)5-6-17-11-13-19(23)14-12-17/h5-14,20H,3-4,15H2,1-2H3/b6-5+