5-bromanyl-2-methyl-1,3,6-triphenyl-isoindole-4,7-dione

Systemtic Name: 5-bromanyl-2-methyl-1,3,6-triphenyl-isoindole-4,7-dione Openeye Name: 5-bromo-2-methyl-1,3,6-triphenyl-isoindole-4,7-dione CAS Name: 5-bromo-2-methyl-1,3,6-triphenylisoindole-4,7-dione IUPAC Name: 5-bromo-2-methyl-1,3,6-triphenylisoindole-4,7-dione Traditional Name: 5-bromo-2-methyl-1,3,6-triphenyl-isoindole-4,7-quinone Formula: C27H18BrNO2 MolecularWeight: 468.34132

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C2C(=C1C3=CC=CC=C3)C(=O)C(=C(C2=O)C4=CC=CC=C4)Br)C5=CC=CC=C5

Isomeric SMILES

CN1C(=C2C(=C1C3=CC=CC=C3)C(=O)C(=C(C2=O)C4=CC=CC=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C27H18BrNO2/c1-29-24(18-13-7-3-8-14-18)21-22(25(29)19-15-9-4-10-16-19)27(31)23(28)20(26(21)30)17-11-5-2-6-12-17/h2-16H,1H3