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

Systemtic Name: 5-(1-adamantyl)-2-(4-hydroxyphenyl)isoindole-1,3-dione Openeye Name: 5-(1-adamantyl)-2-(4-hydroxyphenyl)isoindoline-1,3-dione CAS Name: 5-(1-adamantyl)-2-(4-hydroxyphenyl)isoindole-1,3-dione IUPAC Name: 5-(1-adamantyl)-2-(4-hydroxyphenyl)isoindole-1,3-dione Traditional Name: 5-(1-adamantyl)-2-(4-hydroxyphenyl)isoindoline-1,3-quinone Formula: C24H23NO3 MolecularWeight: 373.44432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=C(C=C6)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=O)N(C5=O)C6=CC=C(C=C6)O

InChI

InChI=1S/C24H23NO3/c26-19-4-2-18(3-5-19)25-22(27)20-6-1-17(10-21(20)23(25)28)24-11-14-7-15(12-24)9-16(8-14)13-24/h1-6,10,14-16,26H,7-9,11-13H2