6,6-diphenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]hexan-1-one

Systemtic Name: 6,6-diphenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]hexan-1-one Openeye Name: 1-[4-[(E)-cinnamyl]piperazin-1-yl]-6,6-diphenyl-hexan-1-one CAS Name: 6,6-diphenyl-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-1-hexanone IUPAC Name: 6,6-diphenyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]hexan-1-one Traditional Name: 1-[4-[(E)-cinnamyl]piperazino]-6,6-diphenyl-hexan-1-one Formula: C31H36N2O MolecularWeight: 452.63034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CCCCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)CCCCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H36N2O/c34-31(33-25-23-32(24-26-33)22-12-15-27-13-4-1-5-14-27)21-11-10-20-30(28-16-6-2-7-17-28)29-18-8-3-9-19-29/h1-9,12-19,30H,10-11,20-26H2/b15-12+