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

Systemtic Name: 2-[[1-(1-adamantylcarbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[[1-(adamantane-1-carbonyl)-4-piperidyl]methyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[[1-[1-adamantyl(oxo)methyl]-4-piperidinyl]methyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[[1-(adamantane-1-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[[1-(adamantane-1-carbonyl)-4-piperidyl]methyl]benzo[de]isoquinoline-1,3-quinone Formula: C29H32N2O3 MolecularWeight: 456.57598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C29H32N2O3/c32-26-23-5-1-3-22-4-2-6-24(25(22)23)27(33)31(26)17-18-7-9-30(10-8-18)28(34)29-14-19-11-20(15-29)13-21(12-19)16-29/h1-6,18-21H,7-17H2