4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-cyclooctyl-isoindole-1,3-dione

Systemtic Name: 4-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-cyclooctyl-isoindole-1,3-dione Openeye Name: 4-[4-(azepane-1-carbonyl)-1-piperidyl]-2-cyclooctyl-isoindoline-1,3-dione CAS Name: 4-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-cyclooctylisoindole-1,3-dione IUPAC Name: 4-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-cyclooctylisoindole-1,3-dione Traditional Name: 4-[4-(azepane-1-carbonyl)piperidino]-2-cyclooctyl-isoindoline-1,3-quinone Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCC(CC4)C(=O)N5CCCCCC5

Isomeric SMILES

C1CCCC(CCC1)N2C(=O)C3=C(C2=O)C(=CC=C3)N4CCC(CC4)C(=O)N5CCCCCC5

InChI

InChI=1S/C28H39N3O3/c32-26(30-17-8-4-5-9-18-30)21-15-19-29(20-16-21)24-14-10-13-23-25(24)28(34)31(27(23)33)22-11-6-2-1-3-7-12-22/h10,13-14,21-22H,1-9,11-12,15-20H2