2-[3-[3-(2-methyl-3-oxidanylidene-butan-2-yl)oxyphenyl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[3-(2-methyl-3-oxidanylidene-butan-2-yl)oxyphenyl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[3-(1,1-dimethyl-2-oxo-propoxy)phenyl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[3-(2-methyl-3-oxobutan-2-yl)oxyphenyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[3-(2-methyl-3-oxobutan-2-yl)oxyphenyl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[3-(2-keto-1,1-dimethyl-propoxy)phenyl]propyl]isoindoline-1,3-quinone Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C)(C)OC1=CC=CC(=C1)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)C(C)(C)OC1=CC=CC(=C1)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23NO4/c1-15(24)22(2,3)27-17-10-6-8-16(14-17)9-7-13-23-20(25)18-11-4-5-12-19(18)21(23)26/h4-6,8,10-12,14H,7,9,13H2,1-3H3