(E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methyl-1-piperazinyl)-1-penten-3-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazin-1-yl)pent-1-en-3-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-4-methyl-5-(4-methylpiperazino)pent-1-en-3-one Formula: C18H24N2O3 MolecularWeight: 316.39476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C)C(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(CN1CCN(CC1)C)C(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H24N2O3/c1-14(12-20-9-7-19(2)8-10-20)16(21)5-3-15-4-6-17-18(11-15)23-13-22-17/h3-6,11,14H,7-10,12-13H2,1-2H3/b5-3+