2-[4-(3-oxidanyl-3-phenyl-piperidin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-(3-oxidanyl-3-phenyl-piperidin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-(3-hydroxy-3-phenyl-1-piperidyl)butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-(3-hydroxy-3-phenyl-1-piperidinyl)butyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-(3-hydroxy-3-phenylpiperidin-1-yl)butyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-(3-hydroxy-3-phenyl-piperidino)butyl]benzo[de]isoquinoline-1,3-quinone Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)(C5=CC=CC=C5)O

Isomeric SMILES

C1CC(CN(C1)CCCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)(C5=CC=CC=C5)O

InChI

InChI=1S/C27H28N2O3/c30-25-22-13-6-9-20-10-7-14-23(24(20)22)26(31)29(25)18-5-4-16-28-17-8-15-27(32,19-28)21-11-2-1-3-12-21/h1-3,6-7,9-14,32H,4-5,8,15-19H2