2-[[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[[1-(1,3-benzodioxole-5-carbonyl)-4-piperidyl]methyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[[1-[1,3-benzodioxol-5-yl(oxo)methyl]-4-piperidinyl]methyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[[1-(1,3-benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[(1-piperonyloyl-4-piperidyl)methyl]benzo[de]isoquinoline-1,3-quinone Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H22N2O5/c29-24(18-7-8-21-22(13-18)33-15-32-21)27-11-9-16(10-12-27)14-28-25(30)19-5-1-3-17-4-2-6-20(23(17)19)26(28)31/h1-8,13,16H,9-12,14-15H2