2-[3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-3-(p-tolyl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(2,2-dimethyl-4-oxanyl)-3-(4-methylphenyl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2,2-dimethyloxan-4-yl)-3-(4-methylphenyl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-3-(p-tolyl)propyl]isoindoline-1,3-quinone Formula: C25H29NO3 MolecularWeight: 391.50266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCN2C(=O)C3=CC=CC=C3C2=O)C4CCOC(C4)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CCN2C(=O)C3=CC=CC=C3C2=O)C4CCOC(C4)(C)C

InChI

InChI=1S/C25H29NO3/c1-17-8-10-18(11-9-17)20(19-13-15-29-25(2,3)16-19)12-14-26-23(27)21-6-4-5-7-22(21)24(26)28/h4-11,19-20H,12-16H2,1-3H3