2-[3-(2,2-dimethyloxan-4-yl)-4-methyl-pentyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(2,2-dimethyloxan-4-yl)-4-methyl-pentyl]isoindole-1,3-dione Openeye Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-4-methyl-pentyl]isoindoline-1,3-dione CAS Name: 2-[3-(2,2-dimethyl-4-oxanyl)-4-methylpentyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2,2-dimethyloxan-4-yl)-4-methylpentyl]isoindole-1,3-dione Traditional Name: 2-[3-(2,2-dimethyltetrahydropyran-4-yl)-4-methyl-pentyl]isoindoline-1,3-quinone Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCN1C(=O)C2=CC=CC=C2C1=O)C3CCOC(C3)(C)C

Isomeric SMILES

CC(C)C(CCN1C(=O)C2=CC=CC=C2C1=O)C3CCOC(C3)(C)C

InChI

InChI=1S/C21H29NO3/c1-14(2)16(15-10-12-25-21(3,4)13-15)9-11-22-19(23)17-7-5-6-8-18(17)20(22)24/h5-8,14-16H,9-13H2,1-4H3