2-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethenyl]-3-oxidanyl-inden-1-one

Systemtic Name: 2-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethenyl]-3-oxidanyl-inden-1-one Openeye Name: 2-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]vinyl]-3-hydroxy-inden-1-one CAS Name: 2-[1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]ethenyl]-3-hydroxy-1-indenone IUPAC Name: 2-[1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethenyl]-3-hydroxyinden-1-one Traditional Name: 3-hydroxy-2-[1-(4-piperonylpiperazino)vinyl]inden-1-one Formula: C23H22N2O4 MolecularWeight: 390.43178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C2=CC=CC=C2C1=O)O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C=C(C1=C(C2=CC=CC=C2C1=O)O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H22N2O4/c1-15(21-22(26)17-4-2-3-5-18(17)23(21)27)25-10-8-24(9-11-25)13-16-6-7-19-20(12-16)29-14-28-19/h2-7,12,26H,1,8-11,13-14H2