2-[2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-ethyl-2-methyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-ethyl-2-methyl-4-(4-methylphenyl)-4-oxanyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-ethyl-2-methyl-4-(4-methylphenyl)oxan-4-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-ethyl-2-methyl-4-(p-tolyl)tetrahydropyran-4-yl]ethyl]isoindoline-1,3-quinone Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CCO1)(CCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)C)C

Isomeric SMILES

CCC1(CC(CCO1)(CCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)C)C

InChI

InChI=1S/C25H29NO3/c1-4-24(3)17-25(14-16-29-24,19-11-9-18(2)10-12-19)13-15-26-22(27)20-7-5-6-8-21(20)23(26)28/h5-12H,4,13-17H2,1-3H3