(E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[4-[oxo-(2-phenylcyclopropyl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-phenylcyclopropanecarbonyl)piperazino]prop-2-en-1-one Formula: C24H24N2O4 MolecularWeight: 404.45836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC3=C(C=C2)OCO3)C(=O)C4CC4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC3=C(C=C2)OCO3)C(=O)C4CC4C5=CC=CC=C5

InChI

InChI=1S/C24H24N2O4/c27-23(9-7-17-6-8-21-22(14-17)30-16-29-21)25-10-12-26(13-11-25)24(28)20-15-19(20)18-4-2-1-3-5-18/h1-9,14,19-20H,10-13,15-16H2/b9-7+