5-(1-adamantyl)-2-(2-methylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(1-adamantyl)-2-(2-methylphenyl)isoindole-1,3-dione Openeye Name: 5-(1-adamantyl)-2-(o-tolyl)isoindoline-1,3-dione CAS Name: 5-(1-adamantyl)-2-(2-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-(1-adamantyl)-2-(2-methylphenyl)isoindole-1,3-dione Traditional Name: 5-(1-adamantyl)-2-(o-tolyl)isoindoline-1,3-quinone Formula: C25H25NO2 MolecularWeight: 371.4715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H25NO2/c1-15-4-2-3-5-22(15)26-23(27)20-7-6-19(11-21(20)24(26)28)25-12-16-8-17(13-25)10-18(9-16)14-25/h2-7,11,16-18H,8-10,12-14H2,1H3