2-[[4-bromanyl-2-[2,4-di(propan-2-yl)phenyl]carbonyl-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-bromanyl-2-[2,4-di(propan-2-yl)phenyl]carbonyl-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-bromo-2-(2,4-diisopropylbenzoyl)phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-bromo-2-[[2,4-di(propan-2-yl)phenyl]-oxomethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-bromo-2-[2,4-di(propan-2-yl)benzoyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[4-bromo-2-(2,4-diisopropylbenzoyl)benzyl]isoindoline-1,3-quinone Formula: C28H26BrNO3 MolecularWeight: 504.41494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)CN3C(=O)C4=CC=CC=C4C3=O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)CN3C(=O)C4=CC=CC=C4C3=O)C(C)C

InChI

InChI=1S/C28H26BrNO3/c1-16(2)18-10-12-21(24(13-18)17(3)4)26(31)25-14-20(29)11-9-19(25)15-30-27(32)22-7-5-6-8-23(22)28(30)33/h5-14,16-17H,15H2,1-4H3