3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-3H-2-benzofuran-1-one Openeye Name: 3-[4-[(E)-cinnamyl]piperazin-1-yl]-3H-isobenzofuran-1-one CAS Name: 3-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]-3H-2-benzofuran-1-one Traditional Name: 3-[4-[(E)-cinnamyl]piperazino]phthalide Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CN(CCN1C/C=C/C2=CC=CC=C2)C3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H22N2O2/c24-21-19-11-5-4-10-18(19)20(25-21)23-15-13-22(14-16-23)12-6-9-17-7-2-1-3-8-17/h1-11,20H,12-16H2/b9-6+