4-ethyl-5-(2-phenyl-2-adamantyl)isoindole-1,3-dione

Systemtic Name: 4-ethyl-5-(2-phenyl-2-adamantyl)isoindole-1,3-dione Openeye Name: 4-ethyl-5-(2-phenyl-2-adamantyl)isoindoline-1,3-dione CAS Name: 4-ethyl-5-(2-phenyl-2-adamantyl)isoindole-1,3-dione IUPAC Name: 4-ethyl-5-(2-phenyl-2-adamantyl)isoindole-1,3-dione Traditional Name: 4-ethyl-5-(2-phenyl-2-adamantyl)isoindoline-1,3-quinone Formula: C26H27NO2 MolecularWeight: 385.49808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1C(=O)NC2=O)C3(C4CC5CC(C4)CC3C5)C6=CC=CC=C6

Isomeric SMILES

CCC1=C(C=CC2=C1C(=O)NC2=O)C3(C4CC5CC(C4)CC3C5)C6=CC=CC=C6

InChI

InChI=1S/C26H27NO2/c1-2-20-22(9-8-21-23(20)25(29)27-24(21)28)26(17-6-4-3-5-7-17)18-11-15-10-16(13-18)14-19(26)12-15/h3-9,15-16,18-19H,2,10-14H2,1H3,(H,27,28,29)