2-[[3-[(2-bromophenyl)methyl]-2-oxidanylidene-cyclohexyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-[(2-bromophenyl)methyl]-2-oxidanylidene-cyclohexyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-[(2-bromophenyl)methyl]-2-oxo-cyclohexyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[(2-bromophenyl)methyl]-2-oxocyclohexyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-[(2-bromophenyl)methyl]-2-oxocyclohexyl]methyl]isoindole-1,3-dione Traditional Name: 2-[[3-(2-bromobenzyl)-2-keto-cyclohexyl]methyl]isoindoline-1,3-quinone Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C(C1)CN2C(=O)C3=CC=CC=C3C2=O)CC4=CC=CC=C4Br

Isomeric SMILES

C1CC(C(=O)C(C1)CN2C(=O)C3=CC=CC=C3C2=O)CC4=CC=CC=C4Br

InChI

InChI=1S/C22H20BrNO3/c23-19-11-4-1-6-14(19)12-15-7-5-8-16(20(15)25)13-24-21(26)17-9-2-3-10-18(17)22(24)27/h1-4,6,9-11,15-16H,5,7-8,12-13H2