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

Systemtic Name: 2-[3-(2,2-dimethyloxan-4-yl)-3-(4-methoxyphenyl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-3-(4-methoxyphenyl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(2,2-dimethyl-4-oxanyl)-3-(4-methoxyphenyl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2,2-dimethyloxan-4-yl)-3-(4-methoxyphenyl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-3-(4-methoxyphenyl)propyl]isoindoline-1,3-quinone Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1(CC(CCO1)C(CCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H29NO4/c1-25(2)16-18(13-15-30-25)20(17-8-10-19(29-3)11-9-17)12-14-26-23(27)21-6-4-5-7-22(21)24(26)28/h4-11,18,20H,12-16H2,1-3H3