[2-[3-oxidanylidene-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl]phenyl] benzoate

Systemtic Name: [2-[3-oxidanylidene-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl]phenyl] benzoate Openeye Name: [2-[3-[4-[(E)-cinnamyl]piperazin-1-yl]-3-oxo-propyl]phenyl] benzoate CAS Name: benzoic acid [2-[3-oxo-3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]propyl]phenyl] ester IUPAC Name: [2-[3-oxo-3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propyl]phenyl] benzoate Traditional Name: benzoic acid [2-[3-[4-[(E)-cinnamyl]piperazino]-3-keto-propyl]phenyl] ester Formula: C29H30N2O3 MolecularWeight: 454.5601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CCC3=CC=CC=C3OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C(=O)CCC3=CC=CC=C3OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O3/c32-28(31-22-20-30(21-23-31)19-9-12-24-10-3-1-4-11-24)18-17-25-13-7-8-16-27(25)34-29(33)26-14-5-2-6-15-26/h1-16H,17-23H2/b12-9+